smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)CCc1ccccc1 9467395 YUBZPDCFIGKOQX-CQSZACIVSA-N 365.437 2.608 50 40 FFGB COC(=O)NNC(=O)c1cccc2c1Oc1nc3ccccc3nc1O2 5526220 ZEZRSWAYGQFHNS-UHFFFAOYSA-N 352.306 2.529 50 40 FFGB C[C@]1(O)NC(S)=C(C#N)[C@@H](c2ccc(Cl)cc2)[C@H]1[n+]1ccccc1 20459103 UUHKKRHAOIPVPD-JFIYKMOQSA-O 358.874 2.929 50 40 FFGB COc1cc(/C=C(/C#N)c2ccc(C(=O)O)cc2)ccc1OCC(=O)O 408541886 IJDKTEHLKJGWAP-NVNXTCNLSA-N 353.330 2.921 50 40 FFGB Cc1ccc(N2C(=O)C[C@@H](NNC(=O)c3cccc(Cl)c3)C2=O)cc1C 70461116 OVHZTSBFRVQGOJ-MRXNPFEDSA-N 371.824 2.523 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)COc2ccc(Cl)cc2)c2ccccc21 5855635 COJPZYOZRFNMQA-PYCFMQQDSA-N 371.824 2.996 50 40 FFGB COc1cc(Br)cc(/C=N/NC(=O)Cc2ccccc2)c1O 880770 DFEGEZBMCZQZCV-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB COc1cccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)c1OC 59444034 UMJTZHWTFJAJIW-KEBDBYFISA-N 352.394 2.732 50 40 FFGB N#C/C(C(N)=O)=C1/S[C@@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 16758875 FKJOGNMPCRQPIO-JQSQVVPISA-N 367.405 2.737 50 40 FFGB CC1CCN(c2ccc(/C=N/NC(=O)c3cccnc3)cc2[N+](=O)[O-])CC1 4117241 YOBOMBRWIXLZIZ-CIAFOILYSA-N 367.409 2.990 50 40 FFGB O=C(/C=C/c1ccc(-c2ccccc2F)o1)NNC(=O)NC[C@@H]1CCCO1 65147240 DOYYAVSTBCWKTN-PLWJUESGSA-N 373.384 2.608 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN(c2ccccc2)S(C)(=O)=O)c(C)c1C 20207451 IDVOLUMQPLGORX-UDWIEESQSA-N 373.478 2.528 50 40 FFGB CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccccc1N 408999447 LBZNYNJQFMJWJO-UDWIEESQSA-N 355.398 2.787 50 40 FFGB COc1ccc(OC)c(C(=O)NNC(=O)Cc2cccc3ccccc23)c1 12061583 UOABJWLTHZQEPC-UHFFFAOYSA-N 364.401 2.861 50 40 FFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1cccc2ccccc12 704969 BFQPVFVFNCABJT-FYJGNVAPSA-N 356.389 2.644 50 40 FFGB CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1cccc2nccnc12 2263814 ITHWISSKJPUDFH-URMYYVDKSA-N 371.441 2.629 50 40 FFGB Cc1cccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1 102607692 CNZKMXHHLBQMEK-HUXGKSLCSA-N 350.212 2.505 50 40 FFGB COC(=O)c1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N(C)C)c2C)cc1 59333762 MSBYKPNXHQHOOT-BOPFTXTBSA-N 351.406 2.876 50 40 FFGB Cc1ccc(OCCOCCOc2ccc(/C=C(\C#N)C(N)=O)cc2)cc1 4508550 MZMZLGWHNZLBDQ-NBVRZTHBSA-N 366.417 2.862 50 40 FFGB CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 408779751 JSZUGLFZNVZANO-GIJQJNRQSA-N 361.741 2.937 50 40 FFGB Cc1ccc(OCC(=O)n2c(C)c(C(=O)NN)c3ccccc32)c(C)c1 216728040 OUOBLUZAXYPUEF-UHFFFAOYSA-N 351.406 2.889 50 40 FFGB Cc1ccc(OCC(=O)N/N=C2/SCC(=O)N2Cc2ccccc2)cc1 33323930 RUPAYNCDCKPXOJ-XUTLUUPISA-N 369.446 2.537 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1 1800456 YMVFBLNFPYODOJ-UHFFFAOYSA-N 356.422 2.525 50 40 FFGB O=C(NNC(=O)c1ccccc1OC[C@@H]1CCCO1)c1ccc(Cl)cc1 22458068 BMQSRGWLKPXNJP-HNNXBMFYSA-N 374.824 2.973 50 40 FFGB Cc1ccccc1OCC(=O)NNC(=O)COc1ccc2ccccc2c1 2051907 NZSIEVWTCSVLDF-UHFFFAOYSA-N 364.401 2.753 50 40 FFGB COC(=O)N/N=C/c1ccc(OCCOc2ccccc2OC)c(OC)c1 4525996 MOPHJRUYJNGRJN-DEDYPNTBSA-N 374.393 2.852 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@H](OC)c2ccccc2)c(OC)c1OC 1425050 GACORYVLZZHMNF-XNHPLOEXSA-N 358.394 2.550 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc(OC)cc2OC)ccc1OC 6595564 YELGVYVINBYLDE-UDWIEESQSA-N 358.394 2.875 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)C(=O)N[C@H](C)c2ccccc2)cc1 7869271 JOULSQKLKNSDAG-HFITWMCCSA-N 353.422 2.803 50 40 FFGB COC(=O)COc1cccc(/C=N/NC(=O)CSCc2ccccc2)c1 5510927 OZCVJWNQYRFTHI-RGVLZGJSSA-N 372.446 2.622 50 40 FFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C/c1ccc(Br)o1 409365835 SGMOPSXMTKFGEE-RQZCQDPDSA-N 365.183 2.506 50 40 FFGB O=C(N/N=C/c1ccccc1C(F)(F)F)C(=O)NC1CCCCCC1 409006377 NLRIRWSVFIQIEF-SRZZPIQSSA-N 355.360 2.995 50 40 FFGB C=CCOc1ccc(/C=C(\C#N)C(=O)NCCOC)cc1Br 408806123 AVPQTNFMQBDWAU-UKTHLTGXSA-N 365.227 2.683 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccc4c(c3)OCO4)c2[C@@H]1c1cccc(O)c1 9704082 XFRMYHQHDHNOSX-MRXNPFEDSA-N 374.356 2.729 50 40 FFGB COc1ccc(/C=N/NC(=O)CSc2nc3ccccc3n2C)cc1 1475009 WAXCHKIGKBGBAJ-YBFXNURJSA-N 354.435 2.824 50 40 FFGB C/C(=N\NC(=O)Cc1ccccc1)[C@H](c1ccccc1)N1CCOCC1 25686147 NOGMXHXZSMRYNZ-KXZIGNATSA-N 351.450 2.795 50 40 FFGB Cc1ccccc1N(CC(=O)NN=C1CCCCCCC1)S(C)(=O)=O 20207516 KEVDLGBESTXHGJ-UHFFFAOYSA-N 365.499 2.978 50 40 FFGB COc1ccc(C(=O)NNC(=O)c2ccccc2F)cc1Br 8561973 AIPPLRFRGZMSPN-UHFFFAOYSA-N 367.174 2.672 50 40 FFGB N#CC(C(=O)CCN1C(=O)c2ccccc2C1=O)=C1Nc2ccccc2N1 5729645 RPMJUDSYSQTVLV-UHFFFAOYSA-N 358.357 2.515 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 409254776 ISTWPHOVPSMAKB-NIZGNDASSA-N 363.417 2.755 50 40 FFGB Cc1cc(C)c(OCC(=O)N/N=C\c2cccnc2)c(Br)c1 35431635 RFEULSXKZDZZIF-OCKHKDLRSA-N 362.227 2.990 50 40 FFGB CN1[C@@H]2[C@@H](Br)CCCCN2c2ccc(F)cc2S1(=O)=O 13117852 OOTIIPYEXYSBQL-GWCFXTLKSA-N 363.252 2.540 50 40 FFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1sc2c(c1C#N)CCCC2 16693854 JZIHFGLKNQARCH-ZROIWOOFSA-N 352.419 2.633 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)C23CCC4C[C@@H](C[C@@H](C4)C2)C3)cc1 19134760 VDZJRRIVPUYNRH-VVVNUSAQSA-N 362.495 2.911 50 40 FFGB C[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N/N=C1\C=C(O)CCC1 105595981 NKPIZPALWPNIQQ-AITJZAAOSA-N 359.470 2.806 50 40 FFGB COCCn1c(C)cc2c(c1=O)[C@H](c1ccccc1Cl)C(C#N)=C(N)O2 2354328 UYXZRNOCJHNWCU-MRXNPFEDSA-N 371.824 2.675 50 40 FFGB C[C@H]1Oc2ccccc2C=C1/C=N/NC(=O)CCNC(=O)OC(C)(C)C 5047121 ODOQJFMAJXUFNA-LNOXHEFASA-N 359.426 2.868 50 40 FFGB O=C(/C=C/c1ccco1)NNC(=O)CCC(=O)Nc1ccccc1Cl 6258670 WGCCKSGVURTDPT-BQYQJAHWSA-N 361.785 2.513 50 40 FFGB CCOc1ccc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])cc1 4775397 OLCXFGJQRCFDRR-YBFXNURJSA-N 357.366 2.831 50 40 FFGB C#CCOc1ccc(OC)cc1/C=N/NC(=O)CNc1ccc(C)cc1 408526472 CDNOXPJUBNBXOW-LPYMAVHISA-N 351.406 2.578 50 40 FFGB Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)c3ccc(F)cc3)c12 14205671 TUCGANAUTGRUHW-UHFFFAOYSA-N 354.341 2.623 50 40 FFGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=C(/C#N)C(=O)N2CCOCC2)o1 408961955 VZAAVMLYVGWXMN-PTNGSMBKSA-N 366.373 2.719 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2C)o1 408801959 XHXHYTUCFDFRIW-UKTHLTGXSA-N 355.350 2.833 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@H]2C=CC[C@H]12)N/N=C1/C[C@H]2C=CC[C@H]12 35884036 GIRIUIXSQOYDQJ-ZNHJOSPTSA-N 354.454 2.683 50 40 FFGB COc1ccc(C(=O)CSC2=C(C#N)C(C)(C)C(C#N)=C(N)N2)cc1 6648881 GBORRPWUEKFFET-UHFFFAOYSA-N 354.435 2.670 50 40 FFGB C/C(CC(=O)NC[C@H]1CCCO1)=N\NC(=O)c1ccc(C(C)(C)C)cc1 101512559 GVFKMIXAWNUGPF-FEMWLQECSA-N 359.470 2.775 50 40 FFGB NNC(=O)c1ccc([C@@H]2c3sc(=O)[nH]c3S[C@H]3[C@@H]4CC[C@H](C4)[C@@H]32)cc1 100972078 KJTWZWQRLVXAGM-RGDJUOJXSA-N 373.503 2.692 50 40 FFGB CCc1cccc(CC)c1NC(=O)C(=O)N/N=C/c1cccc(OC)c1O 408996570 IUOXGJYDTSDWND-CIAFOILYSA-N 369.421 2.614 50 40 FFGB COc1cccc2cc(C(=O)N/N=C/c3cc([N+](=O)[O-])ccc3O)oc12 408970337 GJDKXZZCQKOZPU-GIJQJNRQSA-N 355.306 2.819 50 40 FFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1 38536881 CPONQNKAJJUPOH-DSSNTAQOSA-N 356.422 2.840 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 6595994 UAGCXIZFOCWKSQ-YBFXNURJSA-N 371.349 2.876 50 40 FFGB C=CCN1C(=O)/C(=N/NC(=O)COc2ccccc2Cl)c2ccccc21 18029447 QWHDKGQOYBKFOZ-RELWKKBWSA-N 369.808 2.772 50 40 FFGB O[C@@H]1[C@H]2[C@H]3C[C@H]4[C@H]5[C@@H]3[C@H]1[C@@](c1ccccc1)([C@H]5I)[C@H]24 245264222 CDNDXHOZUAFLPN-FZTSUXCNSA-N 364.226 2.860 50 40 FFGB O=C(CCCC[C@@H]1CCSS1)N[C@@H]1CCc2nnc(O)cc2C1 575610014 NNGHDYRYCZUFIQ-CHWSQXEVSA-N 353.513 2.870 50 40 FFGB O=C(CN1CC=C(c2ccccc2)CC1)NNC(=O)c1ccc(Cl)cc1 7987269 LUOIDEXWZILIHJ-UHFFFAOYSA-N 369.852 2.890 50 40 FFGB COc1ccccc1[C@@H]1[C@H](C(=O)C2CC2)N2C=C(C#N)C=C[C@H]2C1(C#N)C#N 102666388 VTGZRMNOOGIDGF-XUVXKRRUSA-N 370.412 2.822 50 40 FFGB Cc1ccccc1NC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32 408691283 ZFNUKQJPJNMCBQ-IFLCCBJRSA-N 350.212 2.505 50 40 FFGB Cc1ccc(C)c(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2)c1C 36216325 JHAXNNIFNIZFAS-DJKKODMXSA-N 357.366 2.755 50 40 FFGB CCCCN1C(=O)/C(=N\NC(=O)CNc2ccccc2)c2ccccc21 5261196 XFYXOMJITMQCAJ-NMWGTECJSA-N 350.422 2.766 50 40 FFGB CN(C)NC(=O)c1ccc2nc(-c3ccccn3)c(-c3ccccn3)nc2c1 408979418 QMLMTAURMYCGHT-UHFFFAOYSA-N 370.416 2.960 50 40 FFGB O=C(NNS(=O)(=O)c1ccc(Cl)s1)c1ccccc1Cl 7386303 SHGSMJFMPSGZSE-UHFFFAOYSA-N 351.236 2.678 50 40 FFGB C[C@@H](SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1)C(=O)Nc1ccccc1F 9683002 ICPACHAKFFHWHW-GHMZBOCLSA-N 372.425 2.917 50 40 FFGB C/C(=N/NC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1ccccc1 19366802 ZXSOVYRGBXOEPM-NMWGTECJSA-N 364.493 2.653 50 40 FFGB Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1ccc(N(C)C)cc1)C2 409196572 PTXYORIEPKJODN-SSDVNMTOSA-N 350.466 2.835 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=C(\C#N)C(=O)n1nc(C)cc1C 409370007 JHRFSGQLJXWNKS-AWNIVKPZSA-N 356.338 2.673 50 40 FFGB COc1cccc(-n2c(C)cc(C(=O)NNC(=O)c3ccccn3)c2C)c1 40069503 LCUBQZSVWBOPGV-UHFFFAOYSA-N 364.405 2.573 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 6429013 NDRTUVQOBLHICT-SDNWHVSQSA-N 355.350 2.914 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cccc(N3CCCC3=O)c2)cc1OC 822261 WBGKKQSOIIKSFO-FYJGNVAPSA-N 367.405 2.595 50 40 FFGB C[C@H]1C[C@H](C)CN(C(=O)COC(=O)/C(C#N)=C/c2ccc(N(C)C)cc2)C1 6534492 PLAIMSXANCZSMY-CDVYCHGGSA-N 369.465 2.707 50 40 FFGB CCOc1ccccc1NC(=O)CCNC(=O)[C@@H](Br)CC 8733054 AVPLNFRZSNNODF-NSHDSACASA-N 357.248 2.704 50 40 FFGB CCc1c(C(=O)NNC(=O)[C@@H]2CC(C)=C(C)C[C@H]2C(=O)O)csc1C 2765295 ZQPZNPVQFAMIRN-ZIAGYGMSSA-N 364.467 2.827 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCO3)c(OC)c1 38534929 QTCMJKSETNDBFU-UDWIEESQSA-N 356.378 2.515 50 40 FFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1ccc(N(C)C)cc1 5393700 KLNVYWKZWOYNHY-UDWIEESQSA-N 357.410 2.542 50 40 FFGB COc1ccccc1NCC(=O)N/N=C\c1cc2c(cc1Cl)OCO2 32109680 JDDKFJGEUNUUSK-ZBKNUEDVSA-N 361.785 2.640 50 40 FFGB COc1ccc(OC)c(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)c1 4603605 UBGALURRRJDPBS-UKTHLTGXSA-N 352.346 2.948 50 40 FFGB O=C(COC(c1ccccc1)c1ccccc1)NNC(=O)c1cccnc1 32897477 ZISWQRHQUIZKKS-UHFFFAOYSA-N 361.401 2.649 50 40 FFGB CN1/C(=C(\C#N)C(=O)CSc2nnc(N)s2)Sc2ccccc21 102953525 PQOLHFPIWLOQLF-WQLSENKSSA-N 361.477 2.759 50 40 FFGB COc1ccc(N2N=C(C)/C(=C(\C)NNC(=O)c3ccccc3)C2=O)cc1 103916624 HTVWWHRWXOTWIL-AQTBWJFISA-N 364.405 2.626 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1 409051805 CUZBRLAWNWYQFC-KEBDBYFISA-N 360.797 2.964 50 40 FFGB CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(C)n(CC)c(=O)c21 2325924 QZMHKIJXQNAKSY-KRWDZBQOSA-N 351.406 2.794 50 40 FFGB CCC(C)(C)NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C 47624242 FFZOLHAIVQGYKP-UHFFFAOYSA-N 354.454 2.962 50 40 FFGB COc1cccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(N(C)C)cc2)c1 100522996 SBBRNOLXXNNKJH-HYARGMPZSA-N 368.437 2.896 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)cc1OC 4984743 VJDQSEVAYAFBHA-KPKJPENVSA-N 369.333 2.863 50 40 FFGB N#C/C(=C\N1CCN(c2ccc(F)cc2)CC1)C(=O)Nc1ccccc1 5485338 BFTPGOPEPNBDDQ-FOCLMDBBSA-N 350.397 2.994 50 40 FFGB CC(C)(C)OC(=O)N[C@H](CC(=O)OCc1ccccc1)C(=O)CCl 44063066 BKSBJYSNALKVEA-CYBMUJFWSA-N 355.818 2.821 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)ccc1OCC(=O)O 16408558 OJQFWXPWUMRXLZ-MDWZMJQESA-N 370.336 2.843 50 40 FFGB O=C(O)[C@@H](Br)[C@H](Br)c1ccc([N+](=O)[O-])cc1 1737469 FZSNEPIHJADWSK-SFYZADRCSA-N 352.966 2.879 50 40 FFGB in-vitro CCOC(=O)N/N=C(/C)c1ccc(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 18255022 OATKSAVZVHIREP-ALVQJFKWSA-N 357.410 2.836 50 40 FFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 3092264 VGQOAHGMEZEEIQ-HYARGMPZSA-N 353.422 2.632 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O)c1ccccc1 4784678 HCKKOFWIZKEOTE-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB COCC1CCN(S(=O)(=O)c2ccc(CBr)cc2)CC1 88247717 XIBDIAQQJBXBNA-UHFFFAOYSA-N 362.289 2.629 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 15225716 UXEHGVKLQYVADU-NWGMWSOJSA-N 353.422 2.630 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2cccc(Br)c2)cc1 1028191 BZUWRFIRDRZVJQ-VCHYOVAHSA-N 361.195 3.000 50 40 FFGB O=C(NNC(=O)c1ccccc1-c1ccccc1C(=O)O)c1ccncc1 807008 RSIXRXQLXQZGMU-UHFFFAOYSA-N 361.357 2.522 50 40 FFGB COc1ccc(OC)c(/C=N\NC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1 1894170 CTAJFDLNNAXXBK-NHDPSOOVSA-N 368.368 2.997 50 40 FFGB O=C(NCCc1ccccc1)C(=O)N/N=C/c1ccc(Cl)c(Cl)c1 59505946 AJILICQGPQMSHO-SRZZPIQSSA-N 364.232 2.802 50 40 FFGB CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(CC)c(=O)c32)cc1 2242313 ZMIVWFQWRWEHKJ-KRWDZBQOSA-N 351.406 2.794 50 40 FFGB CC(C)[C@@H](Br)C(=O)Nc1cc2nc(O)[nH]c2cc1N(C)C 408534935 WVXUCUQYDWARNC-GFCCVEGCSA-N 355.236 2.693 50 40 FFGB COc1ccc(Br)c(C(=O)NNC(=O)c2ccccc2F)c1 7007638 ZLTUDQHUKLESGP-UHFFFAOYSA-N 367.174 2.672 50 40 FFGB O=C(NNS(=O)(=O)c1ccc(Cl)cc1F)c1ccccc1Cl 7386325 LWRBILZRYLAVEI-UHFFFAOYSA-N 363.197 2.756 50 40 FFGB O=C(N/N=C/c1cc2ccc([N+](=O)[O-])cc2nc1Cl)c1ccncc1 408728710 RTAJVKUABZOJPH-DJKKODMXSA-N 355.741 2.955 50 40 FFGB CO[Si](CCc1ccc(CC[Si](OC)(OC)OC)cc1)(OC)OC 195754676 MAFQBSQRZKWGGE-UHFFFAOYSA-N 374.582 2.528 50 40 FFGB CN1[C@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@@H](c4cccc(F)c4)[C@@H]3[C@H]1CC2 101747848 HSQSGIPRWNRTCY-OAOYMFHYSA-N 359.408 2.712 50 40 FFGB CCCCOc1ccc(C(=O)NNC(=O)c2ccccc2C(=O)O)cc1 2364828 GDBPZUYYHKSELS-UHFFFAOYSA-N 356.378 2.639 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1Br 28699959 LGHZQAYUOWUKTO-WHGQRRHOSA-N 365.227 2.660 50 40 FFGB N#C/C(C(=O)CN1CCCc2ccccc21)=C1\NC(=O)c2ccccc2N1 105220186 PUCCOJHZCONXTE-CAPFRKAQSA-N 358.401 2.599 50 40 FFGB O=C(CN1C[C@@H](c2ccccc2)CC1=O)N/N=C/c1cc(Cl)ccc1O 106648666 OLKOUUIWBYPKTR-LKKXKRCMSA-N 371.824 2.512 50 40 FFGB Cc1nn(-c2ccccc2)c(O)c1/C=N/NC(=O)c1cc(C(C)(C)C)n[nH]1 5490291 XSRQOTFBLVCJDO-RGVLZGJSSA-N 366.425 2.671 50 40 FFGB CC[C@@H]1CCc2sc(C(=O)NNC(=S)NC[C@H]3CCCO3)cc2C1 7974449 VLXIWWWCXHZMOL-DGCLKSJQSA-N 367.540 2.551 50 40 FFGB CC1(C)CC(=O)C2=C(C1)N(c1nc[nH]n1)C(N)=C(C#N)[C@@H]2c1ccccc1 8559532 NRGXTDBLDKCQKZ-INIZCTEOSA-N 360.421 2.746 50 40 FFGB NC(=O)N/N=C1\C(=O)N(CCOc2ccc3ccccc3c2)c2ccccc21 46085168 SWHBDFPMHRZYCS-NMWGTECJSA-N 374.400 2.638 50 40 FFGB CCOC(=O)c1cn(N(C)CCl)c2c(F)c(F)c(F)c(C)c2c1=O 255187471 DSERVVFNGYONQI-UHFFFAOYSA-N 362.735 2.668 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)cc1 19955311 RXRNZAFTDZNGFX-UDWIEESQSA-N 373.478 2.528 50 40 FFGB C[C@]1(CCCc2ccc(N(CCCl)CCCl)cc2)NC(=O)NC1=O 1763112 NXEBFKUVSHFAOQ-QGZVFWFLSA-N 372.296 2.891 50 40 FFGB O=C(N/N=C/c1cc2cc([N+](=O)[O-])ccc2nc1Cl)c1ccncc1 408728352 KBPMTCBYRIBSEN-DJKKODMXSA-N 355.741 2.955 50 40 FFGB O=C(N/N=C/c1c(O)ccc2ccccc12)C(=O)NC1CCCCCC1 409004344 BYXRYOWCPODVIW-FYJGNVAPSA-N 353.422 2.835 50 40 FFGB O=C(N/N=C/c1ccccc1I)c1ccc(O)cc1 3343325 XSGFPTNWXPXNFT-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB COc1cccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1 2291375 CUYGYNXCBKWOBD-VPNURPJOSA-N 371.824 2.852 50 40 FFGB CCCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2ccc(C)cc2)c2ccccc21 5307589 XFLTWELANMSMLL-HNENSFHCSA-N 372.428 2.946 50 40 FFGB COc1cc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)ccc1OCC(N)=O 408569691 PMEIOOXXRIOCDB-SDQBBNPISA-N 366.352 2.639 50 40 FFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)c1cccnc1 6184791 YQFAMSJNADPEIL-YBFXNURJSA-N 358.195 2.620 50 40 FFGB O=C(N/N=C/C=C/c1cccc([N+](=O)[O-])c1)[C@@H]1COc2ccccc2O1 4591985 KWQUAZBGXISWHK-ZCGWABRTSA-N 353.334 2.550 50 40 FFGB Cc1ccc(/C=N/NC(=O)c2ccc(Cn3nc([N+](=O)[O-])cc3C)cc2)o1 2352653 SYQRCSNNGUVDJA-VXLYETTFSA-N 367.365 2.813 50 40 FFGB O=C(COc1ccc(/C=N/NC(=O)c2cccnc2)cc1)Nc1ccccc1 654924 VRENETYCEIAJEZ-YDZHTSKRSA-N 374.400 2.863 50 40 FFGB N#CCCCN1C(=O)/C(=N\NC(=O)c2ccccc2F)c2ccccc21 6231322 FLZBYPGREZEORZ-XLNRJJMWSA-N 350.353 2.610 50 40 FFGB COc1ccc(C(=O)NNC(=O)CCCc2c[nH]c3ccccc23)cc1 14230870 QVOYQIUNIALFMY-UHFFFAOYSA-N 351.406 2.960 50 40 FFGB Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)CC2(C)OCCO2)o1 408723092 MYAWKLRSFZTQHB-YBFXNURJSA-N 373.365 2.766 50 40 FFGB CC(C)=NNC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1 19950429 UBYIDCWDXVRROW-UHFFFAOYSA-N 363.414 2.533 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)c2c(F)cccc2Cl)c1 3427528 LRCPYUUMHLGPTJ-UHFFFAOYSA-N 350.777 2.936 50 40 FFGB CC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)N3CCN(C)CC3)o2)cc1 27018339 KEOHDEAXCOUJFG-QGOAFFKASA-N 363.417 2.830 50 40 FFGB COc1ccc2oc(=O)c(C(=O)NNC(=O)c3ccc(Cl)cc3)cc2c1 2287145 VBDWADUQJOYEAV-UHFFFAOYSA-N 372.764 2.530 50 40 FFGB CC(C)(C)OC(=O)NNC(=O)Cn1c(C(F)(F)F)nc2ccccc21 6653448 OFIBNWILQFRXNR-UHFFFAOYSA-N 358.320 2.611 50 40 FFGB C/C(=N\NC(=O)COc1ccc(C)c(C)c1)c1ccc2c(c1)CC(=O)N2 98054880 SUEXTWIJNUJVLG-HYARGMPZSA-N 351.406 2.717 50 40 FFGB CC1(C)CC(=O)C2=C(C1)OC(C#N)=C(N)[C@]21C(=O)Nc2ccc(Cl)cc21 585145622 GEKGDFRKZSNIPJ-LJQANCHMSA-N 369.808 2.897 50 40 FFGB C[C@@H]1CCC[C@@H](C)N1C(=O)COC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1 4894592 FLVIPETUBIXORZ-SUBKYJBBSA-N 369.465 2.992 50 40 FFGB COC(=O)N/N=C/c1ccc(OS(=O)(=O)c2ccc(Cl)cc2)cc1 4545743 MNJDEYGSGNHPKG-LICLKQGHSA-N 368.798 2.798 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1c(F)cccc1Cl 4721077 HDCZHEQWXLZBPD-QGMBQPNBSA-N 351.721 2.916 50 40 FFGB O=C(NNS(=O)(=O)/C=C/c1ccccc1)C12CC3CC(CC(C3)C1)C2 9515352 UFHGHQQFHGFQQU-VOTSOKGWSA-N 360.479 2.824 50 40 FFGB Cc1cc(C)n(CC(=O)NNC(=O)Cc2ccc(-c3ccccc3)cc2)n1 9949376 LROULAJIJNDQQP-UHFFFAOYSA-N 362.433 2.557 50 40 FFGB O=C(N/N=C\c1ccccc1Cl)C(=O)N/N=C\c1ccccc1Cl 31636929 PSIWOLQLWQMIME-QJUDHZBZSA-N 363.204 2.594 50 40 FFGB COC(=O)CSC1=C(C#N)[C@@H](c2ccc(OC)c(Cl)c2)CC(=O)N1 6441641 ALJSYLGIRMAMIK-SNVBAGLBSA-N 366.826 2.593 50 40 FFGB O=C(Cc1cccc(C(F)(F)F)c1)NNC(=S)NCc1ccccc1 6447756 RAWRRUWASALAEI-UHFFFAOYSA-N 367.396 2.943 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NC(C)C)cc(Br)c1OC 6827416 IRTNKDBTPQOKBF-VZUCSPMQSA-N 353.216 2.898 50 40 FFGB CC/C(=N\NC(=O)COc1ccc(C#N)cc1)c1ccc(OC)c(OC)c1 20786824 ALTKQVAPAXVMCI-OQKWZONESA-N 367.405 2.885 50 40 FFGB COc1ccc(CCNC(=O)/C(C#N)=C\c2cccc(O)c2)cc1OC 6679043 ONAVYVPDEZJTCA-YBEGLDIGSA-N 352.390 2.675 50 40 FFGB Cc1ccc(C)c(OCC(=O)NNC(=O)CCc2c[nH]c3ccccc23)c1 14237765 PXFQGHJBXUIZGX-UHFFFAOYSA-N 365.433 2.944 50 40 FFGB O=C(CN1CCN(Cc2ccccc2)CC1)N/N=C\C=C\c1ccccc1 19849356 UECDLYDMSLAUBB-QTLYDGDGSA-N 362.477 2.620 50 40 FFGB Cc1cc2c(c(=O)n1Cc1ccccc1)[C@H](c1ccncc1)C(C#N)=C(N)O2 1471742 VTMMQXRFVLJFHI-LJQANCHMSA-N 370.412 2.818 50 40 FFGB CCN(CC)Cc1ccccc1CNC(=O)NNC(=O)c1cc(C)oc1C 32795554 HPMTZWVOVVJIDX-UHFFFAOYSA-N 372.469 2.882 50 40 FFGB CCOC(=O)c1ccc(N(CCC(=O)CBr)C(C)=O)cc1 1699613 UYESFORBWMBNFZ-UHFFFAOYSA-N 356.216 2.570 50 40 FFGB N#CC1=C(SCC(=O)NCc2ccco2)NC(=O)C[C@H]1c1ccccc1 6496091 MTSDCUSDEOXHKE-HNNXBMFYSA-N 367.430 2.668 50 40 FFGB O=C(N/N=C/c1ccncc1)C(=O)Nc1ccc(Oc2ccccc2)cc1 58884746 HYRQBGGDKVPROJ-HYARGMPZSA-N 360.373 2.963 50 40 FFGB Cc1ccc(OCC(=O)NNC(=O)c2c[nH]nc2-c2ccccc2)cc1C 12530479 VZEDJVXHZDCCQU-UHFFFAOYSA-N 364.405 2.534 50 40 FFGB CN(C)c1cccc(OCC(=O)N/N=C/c2ccc(N3CCCC3)cc2)c1 4106711 JLRUDSULSIFQMW-PXLXIMEGSA-N 366.465 2.882 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)c2c(C)nc3cc(C)ccn23)c1 831379 LZQPJUJZZZFBGX-RGVLZGJSSA-N 352.394 2.732 50 40 FFGB O=C(N/N=C/c1ccc(OC2CSC2)cc1)c1ccc([N+](=O)[O-])cc1 59437025 QRZLJCVVNDLAFN-GIJQJNRQSA-N 357.391 2.853 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)cc1OC 5381769 NQCVPLXBPHBYMQ-UDWIEESQSA-N 358.394 2.875 50 40 FFGB CCCCOc1ccc(NC(=O)C(=O)N/N=C/c2cccc(O)c2)cc1 409252963 ADSLIOFAMKRRTF-DEDYPNTBSA-N 355.394 2.660 50 40 FFGB CCOC(=O)/C(C#N)=C\c1cn(CCC(=O)O)nc1-c1ccc(C)cc1 6179683 DIIFOIZLVWSCQX-GDNBJRDFSA-N 353.378 2.803 50 40 FFGB CCCOc1cccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1 40144397 HVIZTOJHMQPQSN-UHFFFAOYSA-N 366.215 2.641 50 40 FFGB N#C/C(=C\N1CCN(/C=C/c2ccccc2)CC1)C(=O)NCc1ccco1 20572252 GHGLXGCTFYIRHR-JUMSSORRSA-N 362.433 2.592 50 40 FFGB COc1ccc([C@@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)cc1 12275717 QDPNVWXVENURPF-IFXJQAMLSA-N 368.414 2.931 50 40 FFGB NC(=O)[C@@H](Br)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 100091463 KARJLQXIQFBVED-RDLSHOLPSA-N 351.082 2.969 50 40 FFGB N#C/C(=C/c1cccc([N+](=O)[O-])c1O)C(=O)NCCCc1ccccc1 409238160 COCQJXNEZSYSFP-VBKFSLOCSA-N 351.362 2.956 50 40 FFGB O=C(Cc1ccccc1)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1 409006778 KWLDPLDNLVPICS-XSFVSMFZSA-N 352.394 2.888 50 40 FFGB CC(C)/C=C(\C#N)C(=O)N1CC[C@@H]2O[C@@](C)(COc3cccnc3)C[C@@H]2C1 585289719 MKSFSPXMWOIEQU-ATIJXWPMSA-N 369.465 2.962 50 40 FFGB COc1cc2c(cc1OC)[C@@H]1C/C(=N/NC(N)=O)[C@@H](CC(C)C)CN1CC2 100159619 UZYMRVUJWGYPGN-GFWBCYJCSA-N 374.485 2.693 50 40 FFGB CC(=O)N1CCC2(CC1)C(C#N)=C(N)Oc1c2sc2nc(C)cc(C)c12 809375 PYEGXOYTEVCVJJ-UHFFFAOYSA-N 368.462 2.880 50 40 FFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCCOc1cccc(C)c1 4196586 BIEYQBWNAFIEHD-FYJGNVAPSA-N 357.410 2.854 50 40 FFGB COc1ccc(O)c(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)c1 3577092 FPKLQELUSXXJFB-LSFURLLWSA-N 367.327 2.982 50 40 FFGB COc1ccc(Cl)cc1/C=N/NC(=O)CSc1nc(C)cc(C)n1 8336656 FXQLOOYVWKCFQG-QGMBQPNBSA-N 364.858 2.998 50 40 FFGB C/C(=N\NC(=O)Cn1nnc(-c2ccccc2)n1)c1cc2ccccc2o1 5119672 XDCXBQADNXQLPO-DEDYPNTBSA-N 360.377 2.627 50 40 FFGB COC(=O)c1ccccc1N/C=C(/C#N)S(=O)(=O)c1ccc(OC)cc1 100706639 KYWLCMJSNZEBQO-QINSGFPZSA-N 372.402 2.733 50 40 FFGB Cc1cccc(C(=O)NNC(=O)c2ccccc2NC(=O)c2ccco2)c1 408999433 CUTDWRHHTSGVSD-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccccn2)cc(Br)c1OC 5357264 HEWLIWBSXVDHFO-GIJQJNRQSA-N 364.199 2.625 50 40 FFGB Cc1ccsc1/C=N/NC(=O)CNC(=O)c1ccccc1C(F)(F)F 4086389 CZZHFPNHSNWNEL-ODCIPOBUSA-N 369.368 2.955 50 40 FFGB C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccccc1 8242576 CHXJQGHZQCSTJD-NSHDSACASA-N 363.211 2.678 50 40 FFGB COC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)NC(C)C)cc1Cl 408772046 MTHOUELQIJDGKD-WCIBSUBMSA-N 371.220 2.977 50 40 FFGB CCS(=O)(=O)[C@@H](I)C(=O)c1cccc(Cl)c1 96517946 ASXXADFKQZRWLO-SNVBAGLBSA-N 372.611 2.719 50 40 FFGB CN1C(=O)/C(=N/NC(=O)COc2ccc3ccccc3c2)c2ccccc21 13476898 QFAFQKXVZRZBNR-BSYVCWPDSA-N 359.385 2.716 50 40 FFGB CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Oc1ccc([N+](=O)[O-])cc1 1560640 QCLCPFXPLVJTLB-GOSISDBHSA-N 367.361 2.729 50 40 FFGB O=C(Cn1cc(C(F)(F)F)cc(Cl)c1=O)NNc1ccc(F)cc1 53676229 SMQMVSHOGPMVSL-UHFFFAOYSA-N 363.698 2.803 50 40 FFGB C[C@@H](CNS(=O)(=O)c1ccc(CCCl)cc1)N1CCC[C@@H](C)C1 55591535 VZJLUSYXSDJNMO-CABCVRRESA-N 358.935 2.867 50 40 FFGB COc1cc(/C=C(\C#N)C(N)=S)ccc1Oc1ccc([N+](=O)[O-])cn1 408544719 XBKPIZUGECZVPP-IZZDOVSWSA-N 356.363 2.984 50 40 FFGB C/C(=N\NC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(Cl)cc1 7429108 XSSZSHUILJDDHT-XDHOZWIPSA-N 354.801 2.534 50 40 FFGB O=C(CCCC(=O)N/N=C/c1ccc(F)cc1)N/N=C\c1ccc(F)cc1 31829191 XGLMBDGHMWBHMF-SEKXJNOLSA-N 372.375 2.736 50 40 FFGB CC(=O)c1c(NNC(=O)c2ccc(Br)cc2)oc(C)cc1=O 8048445 PUCPOAMYUKFALL-UHFFFAOYSA-N 365.183 2.670 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1OC(=O)c1ccco1)c1ccco1 409225492 OUZSBULMOMZOJP-ZDLGFXPLSA-N 369.289 2.764 50 40 FFGB O=C(CNC(=O)c1ccc(Cl)cc1)N/N=C\c1cc(Cl)ccc1O 36077397 DRRLVVRCTFKPAT-ZBKNUEDVSA-N 366.204 2.579 50 40 FFGB CC(C)NC(=O)/C(C#N)=C\c1cccc(/C=C(/C#N)C(=O)NC(C)C)c1 57438721 MSFLCLJBAZJWHC-XFQWXJFMSA-N 350.422 2.550 50 40 FFGB N#C/C(=C\c1ccc([N+](=O)[O-])o1)C(=O)NCCc1c[nH]c2ccccc12 874097 HPMKKDZZQQZXEQ-UKTHLTGXSA-N 350.334 2.935 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1 1260381 UZJHJDIKGPCPIZ-VXLYETTFSA-N 369.402 2.857 50 40 FFGB CCCCCCCn1c(SCCCl)nc2c1c(=O)[nH]c(=O)n2C 8435257 UDKKSGOGTJVZSL-UHFFFAOYSA-N 358.895 2.725 50 40 FFGB COc1cccc(C(=O)N/N=C(\C)c2ccc(N3CCOCC3)cc2)c1 5516991 AJNNHRCAAWWBPL-RCCKNPSSSA-N 353.422 2.686 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(C)s3)CC2=O)cc1 409263265 BKMQPHWMYDHDFN-XTBHVRTMSA-N 357.435 2.568 50 40 FFGB COc1cc(C(=O)NNC(=O)c2c[nH]c3ccccc23)cc(Cl)c1O 8735511 ZBXIXQIPBOVCQE-UHFFFAOYSA-N 359.769 2.610 50 40 FFGB C/C(=N\NC(=O)NC[C@H]1CCCO1)c1sc2nc(C)nc(C)c2c1C 84066825 WEODHSKKKWNGHX-SRRANQMSSA-N 361.471 2.819 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@H]2CC=C[C@H]12)N/N=C1\C[C@@H]2CC=C[C@H]12 5725507 KVMHVJCPUHROLG-HBNOETMJSA-N 354.454 2.683 50 40 FFGB Cc1ccc(C[C@@H]2S/C(=C(/C#N)C(N)=O)N(c3ccccc3)C2=O)cc1 2337785 XTGIIRBZBUNRQI-IMGOXIFKSA-N 363.442 2.907 50 40 FFGB COc1ccc(CC(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])cc1OC 4515222 CLRQGEBIUWGTQI-YVUBOPQPSA-N 369.377 2.970 50 40 FFGB COc1cccc(/C=N/NC(=O)CO/N=C(\C)c2cccs2)c1OC 4853096 WWYRIHRQIOINLV-VSLWDWNJSA-N 361.423 2.656 50 40 FFGB C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)COc1ccccc1 5249873 RCRVBURQSHAFKT-PXLXIMEGSA-N 368.437 2.652 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2cccc(F)c2)c(OC)c1 5289229 WLALYYWAIYDHDE-WSDLNYQXSA-N 373.384 2.977 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)NNC(=O)/C=C/c2ccccc2)cc1C 5684289 QBRZLSHKVFVMBE-PKNBQFBNSA-N 365.433 2.883 50 40 FFGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1cccc(OC)c1 8733190 ZCLABCXVVVDSCB-ZDUSSCGKSA-N 357.248 2.704 50 40 FFGB COc1cc(N2CCCC2)c(OC)cc1/C=N/NC(=O)c1ccc(O)cc1 409103150 BCTXFIFDUYOYKO-FYJGNVAPSA-N 369.421 2.774 50 40 FFGB C/C(=N/NC(=O)c1ccc([N+](=O)[O-])cc1)c1cc2ccc(O)cc2oc1=O 13511465 FOBDRWDOZBDPFA-GRSHGNNSSA-N 367.317 2.561 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1OC 3576758 RGSYYEVCYJRLEV-MRUVXERFSA-N 368.389 2.550 50 40 FFGB C[C@@H](Oc1ccccc1[N+](=O)[O-])C(=O)N/N=C/c1c[nH]c2ccccc12 2766998 JMJDXTXPBRMSCG-ZICWZVMQSA-N 352.350 2.994 50 40 FFGB CCCCOC(=O)c1ccc(N/C=C2\C(=O)N(C)C(=O)C(C#N)=C2C)cc1 6756896 WDWDVOVFJJKGIS-ATVHPVEESA-N 367.405 2.778 50 40 FFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2C)nc2ccccn2c1=O 2439726 MWVBCWQNMBZENC-NTCAYCPXSA-N 374.400 2.838 50 40 FFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cn(C)c2ccccc12 409178123 GPOKNYNHLWLCCA-VXLYETTFSA-N 352.350 2.859 50 40 FFGB CCc1ccc(NC(=O)[C@@H]2[C@H]3C[C@H]4[C@H](OC(=O)[C@@H]24)[C@H]3Br)cc1 408677508 BZUUVJPOVIVQMP-MBIARJLFSA-N 364.239 2.759 50 40 FFGB COc1cc(/C=N\NC(=O)Cc2ccc(C)cc2C)c(O)c([N+](=O)[O-])c1 216038276 DKRVRWLOKPVNIN-GRSHGNNSSA-N 357.366 2.619 50 40 FFGB CCOc1cccc(/C=N/NC(=O)Cn2c(C)nc3ccccc32)c1O 6319287 BKIOWNKGNXHXCV-RGVLZGJSSA-N 352.394 2.599 50 40 FFGB COc1cccc2sc(NNC(=O)[C@H]3COc4ccccc4O3)nc12 4121326 WMLRMPWNFMVGNE-CYBMUJFWSA-N 357.391 2.588 50 40 FFGB O=C(Cc1cn2ccsc2n1)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 12587214 AIXNVZFTGWKBFD-FRKPEAEDSA-N 363.786 2.650 50 40 FFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)c1ccco1 2266760 WNBBJIUGJZURKD-WSDLNYQXSA-N 365.389 2.712 50 40 FFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccccc3C(=O)O)ccc21 3469226 WSKRJRCILMOAGM-RGVLZGJSSA-N 350.378 2.827 50 40 FFGB CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc3c(c2)OCCO3)C1=O 9422098 UFCKBBHAGFXUSP-COOUDCDJSA-N 367.405 2.761 50 40 FFGB Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc(O)c(O)c1)C(C#N)=C(N)O2 5537867 CQAIYNXNQYZZTN-GOSISDBHSA-N 360.373 2.810 50 40 FFGB C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@]3(C(=O)Nc4ccccc43)[C@H]2C1 13510016 SLCAPPSOGCMOQX-SAZGQGMLSA-N 355.401 2.633 50 40 FFGB Cc1ccccc1C(=O)NNC(=O)c1cc2cc(Cl)ccc2oc1=O 10384458 DKEKMNPTLOYJCH-UHFFFAOYSA-N 356.765 2.830 50 40 FFGB Cc1cc(C)nc(NNC(=O)Cc2cc(Cl)c3c(c2)OCCCO3)n1 22235452 QHWTUOQNXLTGOM-UHFFFAOYSA-N 362.817 2.594 50 40 FFGB C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@]3(C(=O)Nc4ccccc43)[C@H]2C1 5490101 SLCAPPSOGCMOQX-PKQAIAMASA-N 355.401 2.633 50 40 FFGB C/C(=N\NC(=O)Cc1csc(C)n1)c1ccc(N2CCCC2=O)cc1 7859961 QLFYSSVIHNUXDW-UDWIEESQSA-N 356.451 2.661 50 40 FFGB CC1=C(C#N)C(=O)N(CCC(C)C)C(=O)/C1=C\Nc1ccc2c(c1)OCO2 9422438 JZYVWBVOSFHQCQ-YBEGLDIGSA-N 367.405 2.966 50 40 FFGB CC(C)(C)OC(=O)N1CC[C@@H]2O[C@H](CI)C[C@@H]2C1 95616467 AQIMUCSSHUZPPS-VWYCJHECSA-N 367.227 2.836 50 40 FFGB Cc1ccc(C)c(-c2cc3c(=O)n(Cc4noc(CCl)n4)ccn3n2)c1 98212095 VAZVLYLVOOZTND-UHFFFAOYSA-N 369.812 2.950 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)ccc1O[C@H](C)C(=O)O 4545780 PDPYGSNCQMAQDU-NWFCWYBLSA-N 372.421 2.903 50 40 FFGB CCCCc1ccc(C(=O)NNC(=O)Cc2cn3ccsc3n2)cc1 7774817 KUSOQJAEOCFDKD-UHFFFAOYSA-N 356.451 2.742 50 40 FFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/NNC(=O)c1ccccc1O 16312139 BAASRKVKEAQJER-GZTJUZNOSA-N 364.405 2.550 50 40 FFGB Cc1ccc(S(=O)(=O)N2CCC3(CC2)C[C@H](Br)CO3)cc1 11114109 PZKRTYUDJDEFRO-ZDUSSCGKSA-N 374.300 2.702 50 40 FFGB N#C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccccc2)CC1 5590914 BGQSECVNYXNBPY-VKAVYKQESA-N 362.389 2.851 50 40 FFGB COc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)ccc1O 100202928 ASTKOVTVBDBHEK-INIZCTEOSA-N 374.352 2.542 50 40 FFGB Cc1ccc2c(c1)/C(=N/NC(=O)c1ccncc1)C(=O)N2CCC(C)C 100870099 ORCMHKDPVSTHOB-PYCFMQQDSA-N 350.422 2.917 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)cc1OC 13069955 QJIRBMXBMSSUPE-UKTHLTGXSA-N 352.346 2.948 50 40 FFGB COc1ccc(O)c(/C=N\NC(=O)Cc2ccc(Br)cc2)c1 35494290 JPHLVMFVWURMID-ZDLGFXPLSA-N 363.211 2.856 50 40 FFGB COc1ccc(/C=N/NC(=O)c2sc(NC(C)=O)c(C#N)c2C)cc1 8299849 LXTQRXRAYSOPAP-DJKKODMXSA-N 356.407 2.659 50 40 FFGB O=C(N/N=C/c1ccc(N2CCOCC2)cc1)c1ccc2ccccc2n1 4091495 VUWSCLLPTKQZLM-PXLXIMEGSA-N 360.417 2.835 50 40 FFGB O=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1ccc(O)cc1O 16477707 UDVWLYPPECCAGT-UHFFFAOYSA-N 362.385 2.691 50 40 FFGB CC1(C)[C@H](O)[C@]2(Br)CC[C@]1(CC(=O)O)[C@@H]2Br 103708681 DRSFYJASRKYEEL-UUTMEEIUSA-N 356.054 2.539 50 40 FFGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 58883682 DUOUPUYKOQUUMK-QGMBQPNBSA-N 357.757 2.968 50 40 FFGB COc1ccccc1C(=O)NNC(=O)c1cc2cc(Cl)ccc2oc1=O 10384446 LKHMZVKXNHHKNF-UHFFFAOYSA-N 372.764 2.530 50 40 FFGB Cc1cc(C)c2cc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)[nH]c2c1C 12931100 ZJJRODDYLSPYGS-UHFFFAOYSA-N 365.389 2.897 50 40 FFGB Cc1cccc(N2CCN(C(=O)NNC(=O)c3ccc(F)cc3)CC2)c1C 9732384 HWZUFJZVCKIOMT-UHFFFAOYSA-N 370.428 2.619 50 40 FFGB C#CCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)cc1 409325279 XMNRQZCFYRNHPK-STZFKDTASA-N 352.390 2.870 50 40 FFGB O=C(N/N=C/c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(Cl)c1 409255678 MRQIJIIJYTWHNQ-QGMBQPNBSA-N 352.177 2.788 50 40 FFGB O=C(NNS(=O)(=O)c1cc(Cl)sc1Cl)c1cccs1 32717123 FGDCRQUTDZMVPY-UHFFFAOYSA-N 357.265 2.740 50 40 FFGB Cn1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(C(F)(F)F)n1 253402924 OZLWAEOBHCBCSS-GFCCVEGCSA-N 366.343 2.890 50 40 FFGB NC(=O)NCc1ccc(C(=O)NNc2ccccc2C(F)(F)F)cc1 45480829 YIQUWMFJUQCTCM-UHFFFAOYSA-N 352.316 2.631 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2ccccc2OC)cc1 100522612 BEKHELCEBVBCRA-HYARGMPZSA-N 369.421 2.516 50 40 FFGB Cc1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](Cl)C(=O)O2 4974358 ADWQHMXRYKUWAT-UAGQMJEPSA-N 359.809 2.848 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1 6029129 CHDBAANOLKTJPX-UHFFFAOYSA-N 371.393 2.867 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C 6903188 ZZCSXVZUOWVNKC-SFQUDFHCSA-N 353.422 2.772 50 40 FFGB COc1ccc(OCC(=O)NN=C2CCN(Cc3ccccc3)CC2)cc1 57341935 YDFOHJCXRFMMPR-UHFFFAOYSA-N 367.449 2.842 50 40 FFGB Cc1ccc(C(C)C)cc1OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 6549478 SYGOBLYTBXYPHX-UHFFFAOYSA-N 371.393 2.867 50 40 FFGB CCO[C@]1(c2ccccc2)C[C@@H]1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 4935946 SDYRFMRPNJOSNS-DITKOHGZSA-N 353.378 2.997 50 40 FFGB CCOc1ccc(C(=O)N/N=C/c2ccc(N3CCOCC3)c(F)c2)cc1 20765104 KOWJIBRMYGTQDL-HYARGMPZSA-N 371.412 2.825 50 40 FFGB COc1ccc(Br)cc1/C=N\NC(=O)COc1ccccc1 34722375 JQXCHDKRCMRQLA-ZDLGFXPLSA-N 363.211 2.987 50 40 FFGB CNC(=O)O/N=C/C(C)(C)SSC(C)(C)/C=N/OC(=O)NC 255187027 AVMNHOJQSLRWIG-BGPOSVGRSA-N 350.466 2.609 50 40 FFGB O=C(NNC(=S)NC(=O)c1ccccc1Cl)c1ccc(Cl)cc1 12501641 CFUGTMKOFJMKOV-UHFFFAOYSA-N 368.245 2.943 50 40 FFGB CCOC(=O)C1=C(CBr)NC(=O)N[C@H]1c1ccccc1Cl 33374242 JNUSJEKFDIAYTJ-LBPRGKRZSA-N 373.634 2.906 50 40 FFGB CCOC(=O)c1ccc(NC(=O)C(=O)N/N=C/c2ccccc2Cl)cc1 59434120 BCCZOMDLIVATDY-RGVLZGJSSA-N 373.796 2.606 50 40 FFGB CN1[C@@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@@H](c4cccc(F)c4)[C@@H]3[C@@H]1CC2 100680412 HSQSGIPRWNRTCY-QZHFEQFPSA-N 359.408 2.712 50 40 FFGB Cc1ccc2nc(Cl)c(/C=N/NC(=O)c3ccc(F)cc3)c(=O)n2c1 3191413 LZNSYTRVOGEISV-DNTJNYDQSA-N 358.760 2.559 50 40 FFGB O=C(N/N=C/c1c(O)ccc2ccccc12)C(=O)Nc1ccccc1F 4499499 SDVFZCWQKPZGAN-SRZZPIQSSA-N 351.337 2.773 50 40 FFGB O=C(N/N=C\c1cccc([N+](=O)[O-])c1O)c1cccc(-n2cccc2)c1 409075820 UOCGNVYOQQWZQY-UNOMPAQXSA-N 350.334 2.855 50 40 FFGB O=C(NNc1ccccc1[N+](=O)[O-])c1cccc(OC[C@H]2CCCO2)c1 32903013 CCTKWIXCPMNINC-OAHLLOKOSA-N 357.366 2.910 50 40 FFGB COc1cccc(-n2c(C)cc(C(=O)NNC(=O)c3ccco3)c2C)c1 40069567 DZAVFIUHVHPHIL-UHFFFAOYSA-N 353.378 2.771 50 40 FFGB COc1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2)cc1OC 840340 NKWGLVXEWKRYGK-UHFFFAOYSA-N 350.374 2.932 50 40 FFGB CC1(C)[C@]2(CBr)CC[C@@]1(C(=O)O)[C@H](Br)C2=O 4137282 MFQZVXXGEBQQQI-DADVEIPYSA-N 354.038 2.605 50 40 FFGB O=C(N/N=C\c1ccc([N+](=O)[O-])s1)c1cncc(Br)c1 4888932 YEDSXCJEAFAHKT-NSIKDUERSA-N 355.173 2.578 50 40 FFGB CC(C)(C)NC(=S)NNC(=O)COc1ccc(Cl)cc1Cl 8301610 IBIQLCKAVUWLQI-UHFFFAOYSA-N 350.271 2.666 50 40 FFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)c2cccs2)c2ccccc21 20608617 NWVGULKTOSSOAE-MNDPQUGUSA-N 356.451 2.528 50 40 FFGB COc1cccc(/C=N/NC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1 6508020 TUHHYJJXEGVKJT-CIAFOILYSA-N 364.405 2.750 50 40 FFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@H]2COc3ccccc32)c1C 98052638 XBZFPNPZMWQFIO-OXRZLYTFSA-N 365.433 2.908 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2cccc([N+](=O)[O-])c2)cc1Cl 3096898 AJUULUFDCGUICY-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB COc1ccccc1OCCOc1ccc(/C=C(\C#N)C(N)=O)cc1OC 13896787 ZUXZPBVVAZCRPP-RVDMUPIBSA-N 368.389 2.554 50 40 FFGB N#C/C(=C\c1ccc(O)cc1)c1nnc(N2CCOCC2)n1-c1ccccc1 5525318 QWCJTUHAULYONU-SAPNQHFASA-N 373.416 2.874 50 40 FFGB Cn1cc(/C=N/NC(=O)CNC(=O)OCc2ccccc2)c2ccccc21 408817428 LOISDKZLHMQXTF-SSDVNMTOSA-N 364.405 2.555 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(N2CCCC2)cc1 34253899 BZYVIEFPVNKCMT-MOSHPQCFSA-N 368.393 2.724 50 40 FFGB Cc1ccccc1C(=O)NNC(=O)[C@@H](NC(=O)c1ccccc1C)C(C)C 65521329 FLTVETFYRSOPEP-SFHVURJKSA-N 367.449 2.519 50 40 FFGB N#CC(C#N)=C(C#N)c1sc(N2CCOCC2)nc1-c1ccc(O)cc1 59155121 OVWNZXUFVPJIJW-UHFFFAOYSA-N 363.402 2.677 50 40 FFGB CC(C)CNC(=O)CC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 59515329 NZVHCMLXCBPKSU-OEAKJJBVSA-N 367.449 2.878 50 40 FFGB Cc1c(C)[n+](=O)c2c(n1O)[C@@H](Br)CC[C@@H]2Br 104096688 PLANLDNZPQGAQC-YUMQZZPRSA-N 353.034 2.923 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)N(C)C)cc(Br)c1OC 59334660 VHUUCYMKGFHMJK-WDZFZDKYSA-N 353.216 2.852 50 40 FFGB C[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1ccc(Br)cc1 3148218 BKTXMIHXSDLUDK-ZGXHQARYSA-N 374.238 2.718 50 40 FFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3sccc3C)CC2=O)cc1 2263648 HYMJDFHNDNPPAK-XLTHYULKSA-N 371.462 2.958 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccc(C(=O)O)cc1 18199671 QTGHPOZDYAZAMH-HNNXBMFYSA-N 360.325 2.709 50 40 FFGB COc1cc(OC)c(/C=N/NC(=O)c2ccncc2)cc1Br 5175934 XPLFMSGWQREPSS-GIJQJNRQSA-N 364.199 2.625 50 40 FFGB Nc1ccc(C(=O)NN2C(=O)[C@@H](Cl)[C@H]2c2ccccc2Cl)cc1 5581684 UREJEGPGLHQRMX-UONOGXRCSA-N 350.205 2.758 50 40 FFGB Cc1cc(C)cc(OCC(=O)N/N=C/c2ccc(N3CCOCC3)cc2)c1 6830937 IVACUNZGLGCEAD-HYARGMPZSA-N 367.449 2.669 50 40 FFGB O=C(O)COc1ccc(/C=N/NC(=O)c2ccc(F)cc2)cc1Cl 59303467 YVBGVONAJSDSAI-UFWORHAWSA-N 350.733 2.706 50 40 FFGB COc1cccc(C(=O)N/N=C/c2cccn2-c2ccc(C(=O)O)cc2)c1 4747619 KBWDJICBLTXNGV-FYJGNVAPSA-N 363.373 2.948 50 40 FFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2cccc(Cl)c2)CC(=O)N1 9015129 WEJYFOVCOKIWNP-GFCCVEGCSA-N 350.827 2.975 50 40 FFGB O=C(NCCCN1CCOCC1)[C@@H]1Cc2ccccc2[C@@H]1C(Cl)Cl 95677011 HCDPYHLDBBGAFP-CVEARBPZSA-N 371.308 2.585 50 40 FFGB O=C(NCc1ccc(Cl)cc1)C(=O)N/N=C/c1ccccc1Cl 5583383 WZWDZRLSMWVOIR-KEBDBYFISA-N 350.205 2.760 50 40 FFGB Cc1ccc(OCC(=O)N/N=C2\C(=O)N(C(C)C)c3ccccc32)c(C)c1 2744337 PJLLCXYVKMLFEH-ATJXCDBQSA-N 365.433 2.958 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2C)c1 59516010 IHQGIHFBZYNTEV-FYJGNVAPSA-N 351.406 2.957 50 40 FFGB O=C(N/N=C/c1ccco1)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 409007206 VGTCWVAQWQNBAY-UDWIEESQSA-N 359.813 2.936 50 40 FFGB COc1ccc(CC(=O)N/N=C/c2ccc(Br)o2)cc1OC 4515205 DIYDKZLRSULDLP-RQZCQDPDSA-N 367.199 2.752 50 40 FFGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccc2c(c1)OCO2 4689392 RFXQUQIKTUQVIN-REZTVBANSA-N 363.167 2.647 50 40 FFGB Cc1ccc(N(CC(=O)NN=C2CCCCC2)S(C)(=O)=O)cc1Cl 408771863 ITUDNEHIKSMAGR-UHFFFAOYSA-N 371.890 2.851 50 40 FFGB O=C(N/N=C/c1cc(Br)ccc1O)c1ccc2c(c1)OCO2 2166705 SEXOIOGILQVXFH-REZTVBANSA-N 363.167 2.647 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Cl)[C@H]1COc2ccccc2O1 8106863 CUTCYPNACIOEJG-RIEVCORGSA-N 361.741 2.538 50 40 FFGB CCn1c(=O)c(C(=O)N/N=C/c2ccccc2F)c(O)c2ccccc21 100498546 NOAKAFCKHUVMHW-SRZZPIQSSA-N 353.353 2.630 50 40 FFGB CCOc1c(Br)cc(Br)cc1/C=N/NC(N)=O 7894998 KTORAYQRYZEWBM-LHHJGKSTSA-N 365.025 2.613 50 40 FFGB COc1ccc([N+](=O)[O-])cc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1 108125284 JTKOZTMCGKIJTN-QPEQYQDCSA-N 367.317 2.847 50 40 FFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)COc1ccccc1C 1022431 UNZXDLIOYVNALZ-RGVLZGJSSA-N 358.394 2.550 50 40 FFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1cn(C)c2ccccc12 1297888 PIBCVWFZPYGSIA-SRZZPIQSSA-N 367.405 2.968 50 40 FFGB CCCC(=O)Nc1ccc(C(=O)N/N=C/c2cc(OC)ccc2O)cc1 1434176 UNNPSCANUZTVKU-UDWIEESQSA-N 355.394 2.903 50 40 FFGB COc1cc(/C=C/C(=O)NNC(=O)c2ccoc2C)cc(Cl)c1OC 8351050 FUOOQORXIRJNNC-SNAWJCMRSA-N 364.785 2.733 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)NC2CCCC2)ccc1OCC(=O)OC 409188550 DAQQVBSMXVHYGV-GDNBJRDFSA-N 372.421 2.603 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)cc1 408781350 BQPULCGMXHRSFC-UDWIEESQSA-N 373.478 2.528 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1ccncc1 408994995 KJEYILTYDVNAOP-DEDYPNTBSA-N 353.382 2.744 50 40 FFGB N#C/C(=C\c1cc2ccccc2nc1Cl)c1nn(CCO)c(N)c1C#N 34895044 MCEOGLWCPVOZPJ-MDWZMJQESA-N 364.796 2.595 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)NN=C1CCN(Cc2ccccc2)CC1 55074067 LOUMRSSLMCRIGI-UHFFFAOYSA-N 366.421 2.906 50 40 FFGB C[C@H](CCl)CS(=O)(=O)Nc1cccc(I)c1 72312168 VYPZNFPHEVBNJF-MRVPVSSYSA-N 373.643 2.908 50 40 FFGB COc1cc(/C=N/NC(C)=O)ccc1OCCOc1ccc([N+](=O)[O-])cc1 5726126 YCTXYRXXKXDGLE-XDHOZWIPSA-N 373.365 2.531 50 40 FFGB O=C(NN=C1CCN(Cc2ccccc2)CC1)[C@H]1COc2ccccc2O1 8108034 JGQSMADKPOENNA-HXUWFJFHSA-N 365.433 2.595 50 40 FFGB COc1cc(/C=N/NC(=O)c2c(C)nc3ccc(Cl)cn23)ccc1O 656826 CCJCFMHBDBIFSY-UFWORHAWSA-N 358.785 2.774 50 40 FFGB Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1 101195238 GIADFOWGSIJLCB-HUXGKSLCSA-N 350.212 2.505 50 40 FFGB CCc1ccccc1N(CC(=O)NN=C1CCCCCC1)S(C)(=O)=O 20208871 LHVDFAJQCPXJHP-UHFFFAOYSA-N 365.499 2.841 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC2CCCC2)c(C)n1-c1ccccc1F 408969274 KKQKNDYJRLVRSQ-WSDLNYQXSA-N 370.428 2.742 50 40 FFGB CCOc1cc(C(=O)N/N=C/c2c(C)nn(C)c2F)ccc1OC(F)F 252482407 DESOOZXAVSEUDI-DNTJNYDQSA-N 370.331 2.632 50 40 FFGB C/C(=N\NC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 13882247 HYXBHTJXSCGDPQ-DEDYPNTBSA-N 354.366 2.854 50 40 FFGB O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(Cl)cc(Cl)c1 12807406 UAZRRUWBXJPKFW-AWEZNQCLSA-N 367.188 2.594 50 40 FFGB Cc1cc2c(c(=O)[nH]1)[C@H](c1ccccc1Br)C(C#N)=C(N)O2 16994500 JUZKNQVSJQWZBH-CYBMUJFWSA-N 358.195 2.664 50 40 FFGB CC(C)(C)OC(=O)N1CC[C@H](C(=O)NNc2ccc(F)c(F)c2F)C1 97597219 YPDHQTYCYHEWGX-VIFPVBQESA-N 359.348 2.804 50 40 FFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@H]1c1ccccc1OC(F)F 9791098 IGNOFDUGPADPLG-LBPRGKRZSA-N 360.744 2.698 50 40 FFGB CCCCc1[nH]nc2c1[C@H](c1cc(OC)c3c(c1)OCO3)C(C#N)=C(N)O2 8783261 HBVIXPDQBSHIRL-OAHLLOKOSA-N 368.393 2.708 50 40 FFGB biogenic,in-vitro CCOc1ccc(/C(C)=N/NC(=O)c2ccc(OC)cc2O)cc1[N+](=O)[O-] 409392027 NBPOUJFGLWYZPE-YBFXNURJSA-N 373.365 2.862 50 40 FFGB COC(=O)c1cccc(Cn2cc(/C=N/NC(=O)CC#N)c3ccccc32)c1 408544416 SWPLPFWVTXZJQZ-FSJBWODESA-N 374.400 2.840 50 40 FFGB CC1=NN(c2ccccc2)C(=O)[C@@H]1/C=C(/C#N)C(=O)NCc1ccccc1 408747894 VJKOWCSQVYVDAB-LYPXWFNGSA-N 358.401 2.792 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2cc([N+](=O)[O-])ccc2OC)c(OC)c1 408569207 ZLCPBXFAGHZLJO-YBFXNURJSA-N 373.365 2.775 50 40 FFGB N#CC1=C(N)Oc2oc3ccccc3c(=O)c2[C@@H]1c1ccc2c(c1)OCCO2 1070311 UCDLGUVOEHUQTF-QGZVFWFLSA-N 374.352 2.782 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1O 8558465 PVRIVDQHTKQUPN-RGVLZGJSSA-N 355.394 2.759 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2cc(OC)cc(OC)c2)cc1 17968072 WVYYOPLEFBGHFJ-LDADJPATSA-N 374.418 2.963 50 40 FFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c1C 408969932 XDDPZOCWDUIGBQ-WSDLNYQXSA-N 354.454 2.625 50 40 FFGB CC(C)=NNC(=O)CN(c1ccccc1F)S(=O)(=O)c1ccccc1 408782975 LPDPCKNHDRIING-UHFFFAOYSA-N 363.414 2.533 50 40 FFGB CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCc2ccccc21 13011662 DJYGOOCQMDVGGR-QGZVFWFLSA-N 368.433 2.732 50 40 FFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc3ccccc23)C1)c1ccccc1 7882512 PMKZDRKFPCPYBM-KRWDZBQOSA-N 373.412 2.654 50 40 FFGB Cc1ccc(C(=O)NCC(=O)NNc2ccccc2C(F)(F)F)cc1 12730681 JSDVJHJXXNENNF-UHFFFAOYSA-N 351.328 2.887 50 40 FFGB N#C/C(=C\c1cnn(Cc2ccccc2Cl)c1)C(=O)NC[C@H]1CCCO1 17700370 VSRHTUWISLFENL-QLGNDSFESA-N 370.840 2.787 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1ccc(Cl)cc1 4775404 MOGSFGDIYRPXHH-APSNUPSMSA-N 364.701 2.626 50 40 FFGB CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)c2ccccc2O)cc1 9483666 APTBNLCAFYXXJB-UHFFFAOYSA-N 371.393 2.814 50 40 FFGB CC(C)(C)C1CCC(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1 13007826 XPBVFSMFPNADHS-KVULBXGLSA-N 360.454 2.826 50 40 FFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCCOc1ccccc1C 15939020 RAPNHDUZGYUNNN-FYJGNVAPSA-N 357.410 2.854 50 40 FFGB CCN(CC)c1ccc(C(=O)NNC(=O)COc2ccccc2F)cc1 5172138 QDTDOIHWATZLAV-UHFFFAOYSA-N 359.401 2.512 50 40 FFGB CC(C)c1nc(CC(=O)NNC(=O)Cc2csc(C(C)C)n2)cs1 40158870 XLTRZODEABRNHH-UHFFFAOYSA-N 366.512 2.779 50 40 FFGB Cc1cccc(C)c1OCC(=O)NNC(=O)COc1ccccc1Cl 6860818 GJLNEXUKQHZXMR-UHFFFAOYSA-N 362.813 2.562 50 40 FFGB O=C(NNc1ccccc1[N+](=O)[O-])c1ccc(OC[C@@H]2CCCO2)cc1 33026401 QNURQCUONHCDOV-HNNXBMFYSA-N 357.366 2.910 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)ccc1OCc1cccc(C)c1 409246713 CVDOCIOPZAFCQE-SXGWCWSVSA-N 365.389 2.685 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC2CCCCC2)c(C)n1-c1ccccc1 408985558 MYQVGXXCFSCFOB-HYARGMPZSA-N 366.465 2.993 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC 409366619 XDRQCGHUVHEWFU-YBFXNURJSA-N 357.366 2.613 50 40 FFGB O=C(CCC(=O)N/N=C/[C@@H]1C[C@@H]2CC[C@@H]1C2)N/N=C/[C@@H]1C[C@H]2CC[C@@H]1C2 225690964 NXDNIKYHOJFYMV-HELSKWQBSA-N 358.486 2.843 50 40 FFGB Cc1ccc(-c2cc3c(=O)n(Cc4noc(CCl)n4)ccn3n2)cc1 57509279 BVSPHPXCPRHAIR-UHFFFAOYSA-N 355.785 2.642 50 40 FFGB Cc1cc(C)n(Cc2cccc(C(=O)NNC(=O)c3ccc(F)cc3)c2)n1 2330274 IDGVEDJZWKLWJR-UHFFFAOYSA-N 366.396 2.762 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)c2cc(Cl)ccc2O)c2ccccc21 4266837 DUCSDWSGBGNHJB-SILNSSARSA-N 357.797 2.936 50 40 FFGB COc1cc(/C=N\NC(=O)COc2cccc(Cl)c2)ccc1OCC#N 33683759 ZXNVMIPXZHQBIZ-NHDPSOOVSA-N 373.796 2.780 50 40 FFGB Cc1cccc(C)c1NC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br 408682696 GPWNQOITJRBOCC-RWXDJMAFSA-N 364.239 2.813 50 40 FFGB C[C@H]1CCC/C(=N\NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 33042663 UPJKIARQFPEHDN-XZKWLNOSSA-N 363.483 2.767 50 40 FFGB Cc1ccc(C(=O)NN[C@H]2CC(=O)N(c3ccc(Cl)c(C)c3)C2=O)cc1 100863883 BGVCRGSURCCURT-INIZCTEOSA-N 371.824 2.523 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccccc2C(F)(F)F)c1 2642434 GHELNKNIAGZTQJ-UHFFFAOYSA-N 368.311 2.797 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)c(OC)c1 107748588 NSNPDBLNPPNVHU-UDWIEESQSA-N 358.394 2.875 50 40 FFGB O=C(N/N=C(/CC(=O)C(F)(F)F)c1ccc(F)cc1)c1ccncc1 102495408 IMJZNGVWBABKTC-XKZIYDEJSA-N 353.275 2.876 50 40 FFGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C(=O)O)o1)c1ccco1 409036771 BIKYJADQZKHWGV-GIJQJNRQSA-N 369.289 2.910 50 40 FFGB COc1cc(/C=N/NC(=O)Cn2ccc3ccccc32)cc(OC)c1OC 4676320 VCLVNXQLPVYCNI-CIAFOILYSA-N 367.405 2.817 50 40 FFGB O=C(CCC(=O)c1ccc(Cl)s1)NNC(=O)c1ccccc1O 17576532 UOEDGHGMJQDKEJ-UHFFFAOYSA-N 352.799 2.531 50 40 FFGB O=C(N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O)c1ccccc1 36009217 NOCLBNOITLMAKE-PXNMLYILSA-N 364.155 2.827 50 40 FFGB O=C(N/N=C\c1ccc([N+](=O)[O-])o1)C(O)(c1ccccc1)c1ccccc1 33344348 BMTOULDIHOXTDZ-MOSHPQCFSA-N 365.345 2.574 50 40 FFGB CCS(=O)(=O)[C@H](Br)[C@H](O)c1ccc(Br)cc1 96519072 BFGMUYFZUFDMEZ-ZJUUUORDSA-N 372.078 2.638 50 40 FFGB Cc1nn(C)c(F)c1/C=N/NC(=O)c1ccc(Cn2cc(Cl)cn2)cc1 252507340 WIJZFBTZYFYUGQ-DNTJNYDQSA-N 374.807 2.530 50 40 FFGB CCOC(=O)[C@]1(C)c2[nH]c3ccc(OC)cc3c2CCN1C(=O)CCl 11692294 ORSGRBGGAGVKRN-SFHVURJKSA-N 364.829 2.578 50 40 FFGB COc1cc(/C=N/NC(N)=O)ccc1OCCCOc1ccccc1C 4545182 UHRFMJQTGTZFMI-FYJGNVAPSA-N 357.410 2.854 50 40 FFGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3ccc(O)cc3O)c2)n1 4141736 YVPJNMWHFGORPW-SRZZPIQSSA-N 364.405 2.723 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)c1ccc2ccccc2c1 722545 QXDFKZOGSGMZPP-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB COc1ccc(OC)c([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)c1 2502528 QHDMMOKFGGHDSG-GOSISDBHSA-N 352.346 2.651 50 40 FFGB Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 59515549 QRGVNHAPUGBJNJ-GIJQJNRQSA-N 360.757 2.645 50 40 FFGB O=C1c2ccccc2C(=O)N1C[C@@H]1c2ccccc2CCN1C(=O)CCl 2287359 OUORWLBPGMCLSS-QGZVFWFLSA-N 368.820 2.647 50 40 FFGB CCOC(=O)C1=C(C)NC(S)=C(C#N)[C@@H]1c1ccc(C(=O)OC)cc1 20528820 XEGJTOXZQINUOM-HNNXBMFYSA-N 358.419 2.662 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccccc2C(=O)O)c([N+](=O)[O-])c1 408926884 YXUNAVPMIHRIBV-XYOKQWHBSA-N 367.317 2.847 50 40 FFGB C[C@H](NC(=O)/C(C#N)=C\c1ccc2c(c1)n(C)c(=O)n2C)c1ccccc1 409229598 RRZLUXXPADOTOB-FMNVXAMXSA-N 360.417 2.661 50 40 FFGB CC1(C)[C@]2(C)CC[C@@]1(C(=O)NCC(F)(F)F)[C@@H](Br)C2=O 222241639 XPYVXBMOLCPOGB-BPTDKIDVSA-N 356.182 2.824 50 40 FFGB O=C(CCc1ccccc1)NNc1ncnc2c1cnn2-c1ccccc1 4355107 RRKLXSATLTVHDL-UHFFFAOYSA-N 358.405 2.891 50 40 FFGB C=CCc1cc(/C=C(/C#N)C(=O)N(CC)CC)cc(OC)c1OCC(=O)O 408849132 VAFOLPFLNLLYBW-YBEGLDIGSA-N 372.421 2.662 50 40 FFGB Cc1c(C(=O)NNC(=O)c2cc(Br)c[nH]2)oc2ccccc12 9114147 ODBFLYBTSKJVFA-UHFFFAOYSA-N 362.183 2.907 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1OC 3576760 RGSYYEVCYJRLEV-CIPMJJFUSA-N 368.389 2.550 50 40 FFGB CCOC(=O)C1=C(CBr)N(C)C(=O)N[C@@H]1c1ccc(C)cc1 12412391 PMTWSYPYPDTUFQ-CQSZACIVSA-N 367.243 2.903 50 40 FFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(OC)c(O)c3)ccc21 3241922 HONZTZXKJAHWQU-RGVLZGJSSA-N 352.394 2.843 50 40 FFGB C[C@@H](SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1)C(=O)N(C)c1ccccc1 12622476 SKLFTOMMQHVGHQ-TZMCWYRMSA-N 368.462 2.802 50 40 FFGB O=C(/C=C/c1cc(Br)ccc1F)NNC(=O)c1ccco1 8354592 QXWQUIIDMIUDOL-ZZXKWVIFSA-N 353.147 2.656 50 40 FFGB COc1ccc(SCC(=O)N/N=C\c2cccc([N+](=O)[O-])c2O)cc1 409074960 VSVLVDSPRYCOBN-MFOYZWKCSA-N 361.379 2.551 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)c([N+](=O)[O-])cc1OC 408568454 USDGOJRKWBCVOH-RGVLZGJSSA-N 371.393 2.922 50 40 FFGB O=C(COc1ccccc1Cl)N/N=C\c1ccc(N2CCOCC2)cc1 38537767 XWMMUQUONPGBDT-BKUYFWCQSA-N 373.840 2.706 50 40 FFGB COc1ccc(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)cc1 15423081 MUMDGYJWHXRZOJ-CQSZACIVSA-N 371.275 2.950 50 40 FFGB Cc1cccc(C)c1NC(=O)CCC(=O)N/N=C/c1ccc2c(c1)OCO2 59483836 FKDKLKKVEVVBFV-SRZZPIQSSA-N 367.405 2.901 50 40 FFGB O=C(CCC(=O)N/N=C/[C@H]1C[C@H]2CC[C@H]1C2)N/N=C/[C@H]1C[C@H]2CC[C@H]1C2 103623202 NXDNIKYHOJFYMV-XFAPPPJBSA-N 358.486 2.843 50 40 FFGB COc1cc(Br)cc(/C=C(\C#N)C(=O)NC(C)C)c1OC 4506813 YTLCABFQEKAYQZ-VZUCSPMQSA-N 353.216 2.898 50 40 FFGB C[C@H]1CCC[C@@H](C)N1C(=O)COC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1 12633975 FLVIPETUBIXORZ-GKWWPLGASA-N 369.465 2.992 50 40 FFGB Cc1cc(OCC(=O)N/N=C2\C(=O)N(C)c3ccccc32)ccc1Cl 5488845 HCSKNAQYVDXMFB-FXBPSFAMSA-N 357.797 2.524 50 40 FFGB O=C(NN1C(=O)[C@@H](Cl)[C@H]1c1cccc(Cl)c1)c1ccccc1O 1633518 GVALIQHSELKKKI-UONOGXRCSA-N 351.189 2.881 50 40 FFGB CCCCNC(=O)CSC1=C(C#N)[C@H](c2ccc(F)cc2)CC(=O)N1 6323077 MARUGSMBJOYLAU-AWEZNQCLSA-N 361.442 2.814 50 40 FFGB CCCOc1ccc(C(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 20197615 LQWAUQLPEJKNLN-VXLYETTFSA-N 371.349 2.876 50 40 FFGB COc1ccc(-c2cc(C(=O)N/N=C(/C)c3ccccc3O)[nH]n2)cc1 101037614 RVPLPVWRVXMJGB-NDENLUEZSA-N 350.378 2.945 50 40 FFGB Cc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Br)cc2F)o1 2401295 JDLHDVGAWTVQSY-REZTVBANSA-N 368.162 2.578 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)N2CCCC2)cc(Br)c1O 16437915 ZZOATRGQJHMOHH-IZZDOVSWSA-N 351.200 2.693 50 40 FFGB C[C@]1(C(=O)N/N=C/c2ccco2)CC1(Br)Br 2752185 RVOSTVGDFJFYCJ-ACJFOYDFSA-N 350.010 2.626 50 40 FFGB COc1ccc(-n2c(C)cc(/C=C(C#N)/C(O)=N/S(C)(=O)=O)c2C)cc1 48479564 FGRPGVXDWUKGPK-XNTDXEJSSA-N 373.434 2.926 50 40 FFGB CCOc1ccc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc1OC 409364163 NGEJRBAAFGVUGE-BKUYFWCQSA-N 370.405 2.558 50 40 FFGB N#C/C(=C\N1CCN(c2ccc(F)cc2)CC1)S(=O)(=O)c1ccccc1 6719306 OBRWPYLPZLHXQE-XDJHFCHBSA-N 371.437 2.787 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1ccccc1[N+](=O)[O-] 17074192 VEICXOWIKIHEMI-OAHLLOKOSA-N 360.329 2.654 50 40 FFGB N#C/C(=C/c1cc([N+](=O)[O-])c(Cl)cc1Cl)C(=O)N1CCOCC1 409214561 YFHIIHYUFJYOSE-YHYXMXQVSA-N 356.165 2.667 50 40 FFGB COc1cccc(/C=N/NC(N)=O)c1OCCCOc1ccccc1C 4599573 RWAHOUGHMAKARP-FYJGNVAPSA-N 357.410 2.854 50 40 FFGB C/C(=N\NC(=O)c1ccc(-n2cnnn2)cc1)c1ccc2ccccc2c1 6785944 AKRYILWGSKNFEF-HYARGMPZSA-N 356.389 2.970 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] 409145385 OGMMJZKDWMAMQC-DAQNXSASSA-N 357.366 2.567 50 40 FFGB CCOC(=O)/C(C#N)=C1\C(=O)N(CN2CCC(C)CC2)c2ccccc21 39380629 BQQYYNQOXSRCAX-VLGSPTGOSA-N 353.422 2.563 50 40 FFGB C#CCOc1ccc(Br)cc1/C=N\NC(=O)c1ccccc1O 83327799 DQWUEFPQMGQRJQ-ODLFYWEKSA-N 373.206 2.931 50 40 FFGB Cc1cc(C(=O)N/N=C/c2ccc(OC(=O)c3cccc(F)c3)cc2)[nH]n1 880970 NSAJHJYLOWTGHK-SRZZPIQSSA-N 366.352 2.840 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1ccccc1 13562672 WFIGWBLOVMIXPO-FYJGNVAPSA-N 353.378 2.592 50 40 FFGB N[C@H](CSSC[C@@H](N)C(=O)c1ccccc1)C(=O)c1ccccc1 1577760 ZDBVPJBBFXZIQV-HZPDHXFCSA-N 360.504 2.788 50 40 FFGB CCN(NC(=O)C1CCN(C(=O)c2cccnc2)CC1)c1ccc(C)cc1 29762314 FAJNPGIJYKTHMS-UHFFFAOYSA-N 366.465 2.800 50 40 FFGB CSc1ccc(/C=N\NC(=O)CC(=O)NCCc2ccccc2)cc1 59444515 BEKKBJRLFJEOHB-STZFKDTASA-N 355.463 2.608 50 40 FFGB O=C(N/N=C/c1ccc(Cl)cc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 5072201 YQIILPSCWZGLAS-IMRMQAIZSA-N 359.788 2.982 50 40 FFGB COc1cccc(/C=N/NC(=O)Cc2ccc(Br)cc2)c1O 4735322 VTODVSAGCWKBPE-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB N/C(=N\NC(=O)c1ccccc1)c1cc2c(ccc3ccccc32)oc1=O 4738008 WVLTXOPJTPCQGH-UHFFFAOYSA-N 357.369 2.997 50 40 FFGB C/C(=N/NC(=O)c1ccncc1)c1ccc(NC(=O)C(F)(F)F)cc1 5620752 DQOSXGJPFRZYDC-YVNNLAQVSA-N 350.300 2.736 50 40 FFGB C#CCOc1ccc(OC)cc1/C=N/NC(=O)CC1(C)SCCS1 409263158 HSFFSMYLSKZJJE-LDADJPATSA-N 364.492 2.744 50 40 FFGB NS(=O)(=O)c1ccc(CNC(=O)CCCC[C@@H]2CCSS2)cc1 96115086 UONDCGYCXKQFPL-CYBMUJFWSA-N 374.553 2.664 50 40 FFGB biogenic COc1cccc(/C=N/NC(=O)c2cc3c(OC)ccc(OC)c3[nH]2)c1O 2439568 MUEGUSSEFNNZGS-KEBDBYFISA-N 369.377 2.663 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1[N+](=O)[O-] 6295502 UYYHDOSGCLKLOE-LICLKQGHSA-N 358.310 2.666 50 40 FFGB CC/C(=N\NC(=O)CNC(=O)/C=C/c1ccc(OC)cc1)c1ccccc1 4587420 BIHHDMXUAVUBBY-IODXNZNPSA-N 365.433 2.755 50 40 FFGB COC(=O)c1ccccc1N/C=C(/C#N)C(=O)NCc1ccc(OC)cc1 101396097 UHIFLGHDCGHWII-SQFISAMPSA-N 365.389 2.618 50 40 FFGB O=C(N/N=C/c1cccc(O)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 59101716 ZRJKCZXTZBEHBC-QGMBQPNBSA-N 352.177 2.788 50 40 FFGB COc1cc([N+](=O)[O-])cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c1O 23410839 VVQYPQUBQMIWAR-IZZDOVSWSA-N 355.306 2.560 50 40 FFGB Cc1ccc(C(C)(C)CC(=O)NNC(=O)Cc2cn3ccsc3n2)cc1 9156847 LRIYOOHVKAHEND-UHFFFAOYSA-N 370.478 2.762 50 40 FFGB O=C(NNC(=O)c1cccnc1Nc1cccc(F)c1)NC1CCCC1 65919368 IFKYZAMCOFADTQ-UHFFFAOYSA-N 357.389 2.851 50 40 FFGB Cc1ccc(C(=O)N/N=C\c2ccc(Br)c([N+](=O)[O-])c2)cn1 30707932 BVWZFFUEMGGGEN-IDUWFGFVSA-N 363.171 2.825 50 40 FFGB O=C(Cc1ccccc1)N/N=C/c1ccc(I)cc1 59502296 DYRIADRWDDDFIC-GZTJUZNOSA-N 364.186 2.984 50 40 FFGB N#Cc1cccc(OCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1 44815622 NSASDBSCMPOHPY-UHFFFAOYSA-N 367.449 2.691 50 40 FFGB CCOC(=O)CCC(=O)NNC(=O)c1cc2c(s1)CCCCCC2 7962535 SQXQVZPLHYKBMV-UHFFFAOYSA-N 352.456 2.511 50 40 FFGB Cc1cccc(N(CC(=O)NN=C2CCCCC2)S(C)(=O)=O)c1C 408925920 RZSNDKQVILLKKJ-UHFFFAOYSA-N 351.472 2.506 50 40 FFGB C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)c1ccccc1O 13152140 IQONAOWKRBLITG-FYJGNVAPSA-N 354.410 2.593 50 40 FFGB COc1cccc(NC(=S)NNC(=O)c2ccccc2OC(F)F)c1 13468915 QXGGDNNSDRTTNI-UHFFFAOYSA-N 367.377 2.928 50 40 FFGB CCOc1cc(/C=C(/C#N)c2cccc([N+](=O)[O-])c2)ccc1OCC(N)=O 6892363 FTGMEVBDXNSYQT-NVNXTCNLSA-N 367.361 2.922 50 40 FFGB COC(=O)c1cccc2[nH]cc(/C=C(\C#N)C(=O)NCc3cccnc3)c12 61717502 ITUFIJXKNWIDBG-RIYZIHGNSA-N 360.373 2.573 50 40 FFGB Cc1ncc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)s1 63535128 YLOWWLHYDUWOOM-UHFFFAOYSA-N 367.430 2.959 50 40 FFGB COC(=O)c1ccccc1N/C=C(\C#N)S(=O)(=O)c1ccc(OC)cc1 8844409 KYWLCMJSNZEBQO-NTCAYCPXSA-N 372.402 2.733 50 40 FFGB Cc1cccc(C(=O)OCC(=O)/C(C#N)=C2/Nc3ccccc3N2C)c1O 96915606 BSRGVOMDRNIHDH-RGEXLXHISA-N 363.373 2.724 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2C)cc1OC 7869787 NZPYRJRPDSEBKS-FYJGNVAPSA-N 367.405 2.657 50 40 FFGB COCc1n[nH]c2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 4592556 ZOCPMJWOVAWFMI-GFCCVEGCSA-N 361.199 2.537 50 40 FFGB CC(=O)N/N=C/c1ccccc1OCCOCCOc1ccc(C)cc1 4677369 SPKKZZMGSCAASO-RCCKNPSSSA-N 356.422 2.939 50 40 FFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(N2CCOCC2)cc1C 409109042 XAAMXOXXKRVCFF-HYARGMPZSA-N 367.449 2.913 50 40 FFGB CC(C)C(=O)NNC(=O)c1ccccc1NC(=O)/C=C/c1ccccc1 408999823 WBGFDRQZEWTJPP-OUKQBFOZSA-N 351.406 2.756 50 40 FFGB O=C(CSc1nc2ccccc2o1)N/N=C/c1ccccc1[N+](=O)[O-] 783583 VUKHBTSUSXXEJB-RQZCQDPDSA-N 356.363 2.978 50 40 FFGB COc1ccccc1/C=N/NC(=O)c1cc2cc(OC)c(OC)cc2[nH]1 2342071 IWCZLJNSJIKKBJ-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB CSc1nc(N)[n+]2c(c1C#N)S[C@H]1CCC[C@H](Br)[C@H]12 5353706 NFRNZRKDQMENFF-XHNCKOQMSA-O 358.310 2.508 50 40 FFGB CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3F)[C@H]2C1 13739102 DASOHEDSKCVXGD-FUHWJXTLSA-N 365.387 2.710 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)CCOc1ccccc1 15889938 FFNKZZDLRWKYPL-UHFFFAOYSA-N 362.813 2.644 50 40 FFGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccc([N+](=O)[O-])cc1 2752771 MFGQTROBLIMHCZ-RIYZIHGNSA-N 353.334 2.575 50 40 FFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc(OC)c1OC 716754 TWSVURCWPHWPRC-QGZVFWFLSA-N 354.362 2.636 50 40 FFGB Cc1ccc(OCC(=O)N/N=C2\C(=O)N(C(C)C)c3ccccc32)cc1 6199417 YLVPNLXPVLRVSG-QOCHGBHMSA-N 351.406 2.649 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1OC 408587006 DKPVVDBSTSZGDZ-YBFXNURJSA-N 373.365 2.775 50 40 FFGB O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1cc(-c2ccccc2)[nH]n1 16057671 JMGQWIUNGUIYOP-UHFFFAOYSA-N 359.389 2.562 50 40 FFGB Cc1cc(C)cc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c2C)c1 408972685 QPQHKOOGLRGUFK-FSJBWODESA-N 368.481 2.933 50 40 FFGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)c1ccc(N2CCCC2)cc1 7383905 YWSYLXTXTDBCOX-XDHOZWIPSA-N 354.366 2.665 50 40 FFGB O=C(NN1C(=O)[C@H](Cl)[C@@H]1c1ccccc1Cl)c1ccccc1O 1633511 ZOODFJBHTYHNCK-KGLIPLIRSA-N 351.189 2.881 50 40 FFGB CCOc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)cc([N+](=O)[O-])c1O 100302419 CAZHQBFCYZCVHJ-GUVVJWFSSA-N 361.398 2.976 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc(OC)cc2OC)cc1 102673299 RJGNKKSFUTYVNT-VBKFSLOCSA-N 374.418 2.963 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(Br)o1 107664134 SLKSUWKZTNTBIG-NVNXTCNLSA-N 352.144 2.643 50 40 FFGB CCOc1ccc(-c2cc(C(=O)N/N=C/c3ccccn3)[nH]n2)cc1OC 1836028 WIHCGEJESWCFQY-CIAFOILYSA-N 365.393 2.643 50 40 FFGB C/C(=N\NC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 4567968 OVIMMMUAGAVAFI-CPNJWEJPSA-N 356.382 2.580 50 40 FFGB Cc1cc(C)n(CC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)n1 8300621 FZNWYRMKIRZWDE-UHFFFAOYSA-N 360.483 2.682 50 40 FFGB C=CCc1cc(/C=N/NC(=O)c2ccccc2)cc(OC)c1OCC(=O)O 59247941 IWSFSALDJGPECR-CIAFOILYSA-N 368.389 2.651 50 40 FFGB CS(=O)(=O)c1ccc2nc(NC(=O)/C(C#N)=C/c3ccc[nH]3)sc2c1 41078076 XTMCDOJPQQAQQP-JXMROGBWSA-N 372.431 2.574 50 40 FFGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1ccc([N+](=O)[O-])cc1Cl 226368282 LAIKYUPFMHBBQQ-UHFFFAOYSA-N 372.768 2.803 50 40 FFGB CC(=O)c1ccc(OCCCC(=O)NNC(=O)c2ccccc2F)cc1 2726382 ZUPVZEZXZJQKGI-UHFFFAOYSA-N 358.369 2.649 50 40 FFGB CCOc1ccc(-c2cc(C(=O)NN)nn2-c2ccc(OC)cc2)cc1 59472533 PGCFNOMFPVNECS-UHFFFAOYSA-N 352.394 2.550 50 40 FFGB Cc1cc(NC(=O)c2ccco2)sc1C(=O)NNC(=O)C1CCCC1 47451900 FZEYQXBRGQKMQV-UHFFFAOYSA-N 361.423 2.853 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1)Nc1ccccc1 5595291 ZGOJIOHTAFLHEC-UYRXBGFRSA-N 369.381 2.587 50 40 FFGB O=C(CNC(=O)c1c(F)cccc1Cl)N/N=C/c1c[nH]c2ccccc12 4086382 DYMQWEGJZXSQOC-NUGSKGIGSA-N 372.787 2.841 50 40 FFGB N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N/N=C/c1cccc2cccnc12 2092763 VUVBBCXTQOLSSB-PYGAFPFSSA-N 357.417 2.736 50 40 FFGB biogenic CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@@H]1c1ccc(OCC)cc1 1471960 LZRGOEDRHQYKHM-HNNXBMFYSA-N 362.813 2.949 50 40 FFGB COc1cccc(OC)c1/C=N/NC(=O)c1c(C)nc2ccc(C)cn12 408973556 UHCBAECKYLGXFQ-KEBDBYFISA-N 352.394 2.732 50 40 FFGB Cc1cc(CSc2ncccc2C(=O)NNC(=O)c2ccoc2C)no1 30060924 UKQURPMKEOPUGI-UHFFFAOYSA-N 372.406 2.647 50 40 FFGB O=C(Cc1cn2ccsc2n1)NNC(=O)c1cc2c(s1)CCCCC2 24473767 ILHUYUYTLUOISD-UHFFFAOYSA-N 374.491 2.730 50 40 FFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc(Br)ccc1F 664345 UVUODLYOTWSZBX-ZDUSSCGKSA-N 367.174 2.843 50 40 FFGB O=C(NN=C1CCN(Cc2ccccc2)CC1)[C@@H]1COc2ccccc2O1 58650436 JGQSMADKPOENNA-FQEVSTJZSA-N 365.433 2.595 50 40 FFGB COc1cccc(C(=O)N/N=C(/CC(=O)C(F)(F)F)c2ccncc2)c1 6259012 BVQXGQMMJOCSSV-HMAPJEAMSA-N 365.311 2.746 50 40 FFGB Cc1cc(/C=N/NC(=O)CC2(C)OCCO2)c(C)n1-c1ccccc1F 28216687 CBIBKLLIHZRSPP-CIAFOILYSA-N 359.401 2.836 50 40 FFGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C1=NN(c2ccccc2)[C@H](N)[C@@H]1C#N 408903940 BMGUAXWNAZIKKJ-DEYISHSISA-N 374.360 2.508 50 40 FFGB COc1ccc(/C=C/C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1 1781551 BIMUVUVITBTQBR-RMKNXTFCSA-N 354.406 2.552 50 40 FFGB COc1cc(OC)c([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)c(OC)c1 85409019 NPVBMACTZGCMNY-QGZVFWFLSA-N 354.362 2.636 50 40 FFGB Cc1cc(=O)c2c(o1)OC(N)=C(C#N)[C@H]2c1ccc(Br)cc1 1073586 LGKXNJAWUBNXRJ-CYBMUJFWSA-N 359.179 2.929 50 40 FFGB CCOc1ccc(N[C@@H](C)C(=O)N/N=C/c2cccc(OC)c2O)cc1 695598 VKKOVZDJUTUFJG-DZUMZMOTSA-N 357.410 2.750 50 40 FFGB CC(=O)NNC(=O)CSc1nc(C)c(C)n1[C@@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 107329184 PFXSEEHHDLLQOM-TUUVXOQKSA-N 364.515 2.757 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cccn2-c2ccc(C(=O)O)cc2)cc1 409233468 SJAQNJPNFFAYMV-FYJGNVAPSA-N 363.373 2.948 50 40 FFGB COc1cc(OC)cc([C@H]2C(C#N)=C(N)Oc3n[nH]c(C(C)(C)C)c32)c1 9042831 XSFMMCAORJTELJ-AWEZNQCLSA-N 354.410 2.943 50 40 FFGB COc1cc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc(OC)c1O 12859183 BVRPQKHJOBCZLD-UFFVCSGVSA-N 372.421 2.864 50 40 FFGB CCc1ccc(CN(C)[C@@H](C)C(=O)NNC(=O)c2ccc(F)cc2)cc1 8328159 VEJVJWWYGXMVDT-AWEZNQCLSA-N 357.429 2.670 50 40 FFGB O=C(N/N=C/c1cccc(Br)c1)C(=O)Nc1ccccc1F 3008839 FRXFYOMKDKPLAW-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccccn2)cc(Br)c1O 2338419 IQHLEDWNLKCICT-GIJQJNRQSA-N 364.199 2.712 50 40 FFGB CC[C@H]1CCCCN1C(=O)COC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2 6496780 HBRPJLDCBOJBFY-TYWAAFNRSA-N 370.405 2.657 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1 4888472 HCSOFUOFDZTDKE-HZPDHXFCSA-N 358.825 2.978 50 40 FFGB COc1cccc(C=NNC(=O)CSc2nc3ccccc3o2)c1O 254507665 DMTYWBOXTPQNBL-UHFFFAOYSA-N 357.391 2.784 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)CNc2ccccc2C)c2ccccc21 13583417 JKZOCVZERIMJRE-NMWGTECJSA-N 350.422 2.684 50 40 FFGB CC(=O)Nc1ccc(/C=C2\SC(=S)N(C=C(C#N)C#N)C2=O)cc1 16958434 RCCCDCPONOAMFR-NSIKDUERSA-N 354.416 2.777 50 40 FFGB O=C(NNC(=O)c1cc2ccccc2cc1O)c1ccc([N+](=O)[O-])cc1 3081950 YAQGKLZFKZAGAU-UHFFFAOYSA-N 351.318 2.528 50 40 FFGB CCCNC(=O)CSC1=C(C#N)[C@@H](c2ccc(OCC)cc2)CC(=O)N1 6879720 XYJYQGUXSBFJRA-OAHLLOKOSA-N 373.478 2.683 50 40 FFGB CC[C@H](NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc(C)on1 28625854 XFNKXWDEHVDQSP-ZBUUCQELSA-N 360.458 2.537 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2)cc1 3059332 VGNSOFUEHDDMDB-UDWIEESQSA-N 357.797 2.994 50 40 FFGB CC(C)(C)C1CCC(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1 13007827 XPBVFSMFPNADHS-MQBCKMQZSA-N 360.454 2.826 50 40 FFGB O=C(Cn1cnc2ccccc21)N/N=C/c1cn[nH]c1-c1ccc(F)cc1 5572560 YHFPFUITXAUESC-LSFURLLWSA-N 362.368 2.716 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1 825387 YGUDSVCUQHKETI-UHFFFAOYSA-N 373.412 2.943 50 40 FFGB O=C(N/N=C/c1sc(=O)n(Cc2ccccc2)c1Cl)c1ccncc1 2307947 JFLHPIQJVIVHTF-KEBDBYFISA-N 372.837 2.770 50 40 FFGB C/C(CC(=O)NC1C2CC3CC(C2)CC1C3)=N\NC(=O)c1ccncc1 100090482 HTKXTQSUTIXBEB-FSJBWODESA-N 354.454 2.518 50 40 FFGB C[C@H](Cn1cnc2ccccc21)C(=O)N/N=C\c1ccc([N+](=O)[O-])cc1 35188751 QSRZERWUFRYBJZ-CFFVULROSA-N 351.366 2.731 50 40 FFGB Cc1ccc(NNC(=O)Cn2cccc(C(F)(F)F)c2=O)cc1Cl 30556150 FEWPEDVJZNBFCL-UHFFFAOYSA-N 359.735 2.972 50 40 FFGB COc1cc2c(cc1/C=N/NC(=O)c1ccc(-n3cccc3)cc1)OCO2 409099484 NSNNLJWHLXVYCQ-CIAFOILYSA-N 363.373 2.979 50 40 FFGB COc1cccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1 409156374 OCHBZEAVKYRFAX-ORWNMUSCSA-N 365.433 2.815 50 40 FFGB CCn1ncc(/C=N/NC(=O)COc2cc(Cl)ccc2Cl)c1F 252494362 NTQQWQQORKTKCX-NGYBGAFCSA-N 359.188 2.878 50 40 FFGB CCOc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OCC(N)=O 4453121 QQRQOEVYNQPGOQ-ZROIWOOFSA-N 362.389 2.890 50 40 FFGB O=C1O[C@H]2[C@@H]3C[C@@H]([C@H]2Br)[C@H](C(=O)Nc2ccccc2Cl)[C@@H]13 100198300 IHRKASQQGMYREB-BMMXIWBESA-N 370.630 2.850 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)C(=O)Nc2cccc(OC)c2)cc1 105058550 SKWIRAIJZXSGGM-STZFKDTASA-N 368.437 2.630 50 40 FFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2CCCCC2)c1 4964597 PVTBMWACLTVDQU-UHFFFAOYSA-N 351.472 2.767 50 40 FFGB CCN1C(=O)/C(=N\NC(=O)COc2c(C)cccc2C)c2ccccc21 8497258 DFKACTVICYAWJL-PYCFMQQDSA-N 351.406 2.569 50 40 FFGB O=C(N/N=C/c1ccccn1)C1CCN(C(=O)c2ccccc2Cl)CC1 409006631 QHTXABKFGBZCPC-LPYMAVHISA-N 370.840 2.738 50 40 FFGB C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OCC(=O)OCC 408768159 UIMANGKDMJKIAA-BOPFTXTBSA-N 356.422 2.789 50 40 FFGB Cc1ccc(/C=N/NC(=O)c2ccc(I)cc2)o1 10476128 SJYBHMWGTWLKNT-OVCLIPMQSA-N 354.147 2.957 50 40 FFGB N#C/C(=C(/O)CSC(=S)N1CCOCC1)c1nc2ccccc2[nH]1 101477868 JJEUIPUVRNDLSY-KAMYIIQDSA-N 360.464 2.706 50 40 FFGB O=C(Nc1ccccc1)Nc1snnc1C(=O)N/N=C/c1ccco1 1416991 JAUIFBCNTQOXFV-CXUHLZMHSA-N 356.367 2.539 50 40 FFGB O=C(CCC(=O)Nc1ccccc1)NNC(=O)Nc1ccc(Cl)cc1 1895008 ZWOTUVBJJSAJFT-UHFFFAOYSA-N 360.801 2.912 50 40 FFGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)CNc1ccc2c(c1)OCO2 13496258 WJZKZBJPEOMXAJ-ZVBGSRNCSA-N 350.378 2.767 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1c(C)nn(-c2ccc(F)cc2)c1C 7007429 ZZZYPFAJUPRDPE-RVDMUPIBSA-N 356.401 2.688 50 40 FFGB Cc1cc(/C=N/NC(=O)COc2ccc(Br)cc2)c(C)n1C 408778960 NPSJSIRJBCUDCY-GIJQJNRQSA-N 364.243 2.934 50 40 FFGB Cc1ccc2c(c1)/C(=N/NC(=O)c1cc(Br)ccc1O)C(=O)N2 13563556 DGUBICBZKJHDFA-UHFFFAOYSA-N 374.194 2.549 50 40 FFGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 8558543 YWIUUMPMDMQFAX-YBFXNURJSA-N 354.366 2.953 50 40 FFGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1cccc(OC)c1 8733191 ZCLABCXVVVDSCB-CYBMUJFWSA-N 357.248 2.704 50 40 FFGB C[C@H]1C=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3)[C@]2(C)CN1C 35212993 MNEKLXLKKDRVIN-CYFNAFFESA-N 361.424 2.959 50 40 FFGB CCOC(=O)c1ccc(-n2c(C)cc(/C=N/NC(=O)CC#N)c2C)cc1 59427388 DESSNUZOJJXXTK-CIAFOILYSA-N 352.394 2.635 50 40 FFGB COc1cc(SC)ccc1C(=O)NNC(=O)COc1cccc(C)c1 3363047 OOFFCLKTYCAILQ-UHFFFAOYSA-N 360.435 2.566 50 40 FFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C(/C)CCc2ccccc2)c1 59515794 XUDJDSQUVJCTJK-HMAPJEAMSA-N 369.421 2.767 50 40 FFGB CCOC(=O)NNC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1 24716227 NGBQPXSTEKSYND-UHFFFAOYSA-N 350.378 2.930 50 40 FFGB C[C@]1(O)NC(S)=C(C#N)[C@H](c2ccc(Cl)cc2)[C@@H]1[n+]1ccccc1 20459101 UUHKKRHAOIPVPD-XYJFISCASA-O 358.874 2.929 50 40 FFGB C#CCOc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OC 2163686 IHMSYEYSDGOVPA-GOSISDBHSA-N 350.374 2.522 50 40 FFGB Cc1cccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccco3)cc2)c1 66784066 SRKNAFSPMXBJLU-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB C#CCOc1c(/C=C(\C#N)C(=O)OCC)cc(Br)cc1OC 408825065 RGGHASNIKHISLZ-KPKJPENVSA-N 364.195 2.940 50 40 FFGB COc1cccc(-n2c(C)cc(C(=O)NNC(=O)c3cccnc3)c2C)c1 36394918 OPIOAAROAYJJGW-UHFFFAOYSA-N 364.405 2.573 50 40 FFGB COc1ccc(OCCCOc2c(/C=N/NC(N)=O)cccc2OC)cc1 41108624 PXOOBIVFZHYFCF-FYJGNVAPSA-N 373.409 2.554 50 40 FFGB Cc1cc(C(=O)NN)cc(C)c1OC(=O)c1cccc(Br)c1 256053959 UIZABXJBFWTORJ-UHFFFAOYSA-N 363.211 2.889 50 40 FFGB COC(=O)C1=C(C(=O)c2cccs2)[C@@H](c2ccccc2)C(C#N)=C(N)O1 85408961 BOVXRMZBVPJVKO-AWEZNQCLSA-N 366.398 2.866 50 40 FFGB COCCn1c(C)cc2c(c1=O)[C@@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 2205275 BOGXZWSOJBJWCO-INIZCTEOSA-N 371.824 2.675 50 40 FFGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccc([N+](=O)[O-])o1 8812624 FJVCLAKOMJPLGT-VIZOYTHASA-N 368.143 2.723 50 40 FFGB COC(=O)[C@@]12CC[C@@](CBr)(C(=O)[C@@H]1Br)C2(C)C 109275162 PVYFESIMHVMBHV-UPZJHPNMSA-N 368.065 2.693 50 40 FFGB O=C(NNS(=O)(=O)c1ccc(Cl)cc1F)c1cc2c(s1)CCC2 7379766 KWLKWQURHSRJEN-UHFFFAOYSA-N 374.846 2.653 50 40 FFGB CCNC(=S)NNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 7988088 SJRHRDUCCCRHHC-UHFFFAOYSA-N 359.295 2.853 50 40 FFGB O=C(NCCc1ccccc1)C(=O)N/N=C/c1ccccc1C(F)(F)F 4699479 NHXSQHWJFPZTJU-FSJBWODESA-N 363.339 2.514 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc1 408866991 IGUSFUQPLIOIML-RUCZPBRESA-N 358.438 2.905 50 40 FFGB O=C(NNC(=O)[C@H]1Cc2ccccc2S1)[C@H]1Cc2ccccc2S1 40158827 MZPFEIFWEXCNNX-HZPDHXFCSA-N 356.472 2.568 50 40 FFGB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/NNC(=O)c1ccc(O)cc1 101140642 JKWDFAPQZVQSHG-MHWRWJLKSA-N 370.796 2.587 50 40 FFGB O=C(CCl)N(c1cc(Cl)ccc1Cl)[C@@H]1CCS(=O)(=O)C1 111923890 CYFZGQALKHKOSF-SECBINFHSA-N 356.658 2.752 50 40 FFGB CC1=C(C)/C(=N/OS(=O)(=O)c2ccccc2)[C@@H](Cl)[C@H](Cl)C1=O 105883098 OYWDQWATOQHBBL-HALWSDQMSA-N 362.234 2.882 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)OCC(=O)NC2CCCCCC2)cc1 3239267 VILOHKRRRWSMEG-FOWTUZBSSA-N 356.422 2.984 50 40 FFGB CCCCc1[nH]nc2c1[C@@H](c1cc(OC)cc(OC)c1)C(C#N)=C(N)O2 4631775 JEYFLEMDBMYOLV-INIZCTEOSA-N 354.410 2.988 50 40 FFGB C/C(=N/NC(=O)CNC(=O)c1cccnc1)c1ccc(Cl)c(Cl)c1 4833779 TZBCTCMDIAOVAC-FBHDLOMBSA-N 365.220 2.659 50 40 FFGB O=C(CCC(=O)Nc1ccc(F)cc1)N/N=C/c1ccc([N+](=O)[O-])cc1 1949147 MFHWCIRSWRAIAD-YBFXNURJSA-N 358.329 2.603 50 40 FFGB COC(=O)/C(C#N)=C/c1c(Oc2ccccc2F)nc2ccccn2c1=O 2428412 GHNIPIYDTFQNAR-ZRDIBKRKSA-N 365.320 2.706 50 40 FFGB CCCc1nc2c(o1)NC(N)=C(C#N)[C@H]2c1cc(OC)c(OC)cc1OC 1073798 OBNREJNDAJUHPH-MRXNPFEDSA-N 370.409 2.904 50 40 FFGB COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1 803667 OBNOZLLSAKMJIT-INIZCTEOSA-N 374.352 2.798 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(C(F)(F)F)cc2)c1 3358863 NLRMLMXYHPDNIG-UHFFFAOYSA-N 368.311 2.797 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2cccc3ccccc23)c1 4677393 PRYPYWIJDSHNHQ-UHFFFAOYSA-N 350.374 2.932 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)[C@@H]2COc3ccccc3O2)c(O)c1 31875854 JXNQIWOHLPGYPI-VFAFIFLJSA-N 369.421 2.529 50 40 FFGB CC(=NNC(=O)c1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])cc1 254404006 VHTACCXGGLQGBU-UHFFFAOYSA-N 363.377 2.994 50 40 FFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1cc(Cl)ccc1O 695636 AMVLDPJYISWEAW-DJKKODMXSA-N 364.785 2.835 50 40 FFGB COc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)COc1ccc(C)c(C)c1 1437683 JLJQBNWTZPDRCO-VXLYETTFSA-N 357.366 2.749 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])c(O)c3ncccc23)cc1 59459152 GPUPDWYTVOVFTB-KEBDBYFISA-N 366.333 2.621 50 40 FFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\NC(=S)Nc1cccc2ccccc12 100959092 PYPDFQGPEFINFS-GDNBJRDFSA-N 362.414 2.507 50 40 FFGB O=C(COc1ccc2ccccc2c1)NCC(=O)N/N=C/c1cccs1 2121858 VBUKBYPEUDPNAY-SRZZPIQSSA-N 367.430 2.547 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)OC(C)C)ccc1O[C@H](C)C(=O)N(C)C 13135232 YZQGHBNIIHBGIK-DWKHYPNZSA-N 374.437 2.799 50 40 FFGB CC[C@@H]1CCCCN1C(=O)COC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2 6489809 HBRPJLDCBOJBFY-QOBZYLRHSA-N 370.405 2.657 50 40 FFGB CCCCc1n[nH]c2c1[C@@]1(C(=O)Nc3ccc(Cl)cc31)C(C#N)=C(N)O2 8568085 ZHNXHSJJBHISNZ-SFHVURJKSA-N 369.812 2.730 50 40 FFGB CCc1nnsc1C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1 12877264 ZEUYYORNHCSGAN-UHFFFAOYSA-N 362.455 2.600 50 40 FFGB CCOC(=O)C1=C(CBr)NC(=O)N[C@@H]1c1ccc(Cl)cc1 3887501 GOASUOWJKOMELR-GFCCVEGCSA-N 373.634 2.906 50 40 FFGB C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc(-n2ccnc2)cc1 5071419 QWFMXHJDJKEJDQ-VZMFNRANSA-N 362.389 2.553 50 40 FFGB Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)oc2ccc(F)cc12 14168494 VXAJPLYUQWQZJM-UHFFFAOYSA-N 356.309 2.684 50 40 FFGB C/C(=N\NC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O)C(C)(C)C 408779962 OSENFXRGWRRADD-NBVRZTHBSA-N 353.488 2.608 50 40 FFGB COc1ccccc1NC(=O)N/N=C\c1ccc(O[C@@H](C)C(=O)O)cc1 408848392 YNCBZFAHKFNADP-XHEYCZLTSA-N 357.366 2.703 50 40 FFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(N3CCCCC3)o2)c1 6022574 WNYRRAUQELRTON-DEDYPNTBSA-N 354.410 2.992 50 40 FFGB CCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2Cl)s1 1501743 JTEBZZJQCHTKEZ-RQZCQDPDSA-N 365.846 2.623 50 40 FFGB NC(=O)c1ccc[n+](CCN(CCCl)c2ccc3ccccc3c2)c1 1763306 MEPZWMPNBQRNCY-UHFFFAOYSA-O 354.861 2.972 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)COc3ccccc3C)ccc21 8710438 YOCJCDXBSNGEHJ-UHFFFAOYSA-N 366.421 2.513 50 40 FFGB CCOCCCNC(=O)/C(C#N)=C/c1cccc(OC)c1OC(F)F 7990044 ZQGYBCBOFKSMOH-JLHYYAGUSA-N 354.353 2.746 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2ccc(OC)cc2)cc1 100522620 UNKTYPJZOHTVNC-HYARGMPZSA-N 369.421 2.516 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCC1)c1ccccc1Cl 20493202 YYBCCAMZVCXLOC-UHFFFAOYSA-N 357.863 2.542 50 40 FFGB COc1ccc(CC(=O)NNc2ncnc3c2cnn3-c2ccccc2)cc1 2352383 KZQDCLLBKQXWSX-UHFFFAOYSA-N 374.404 2.510 50 40 FFGB aggregator CCOC(=O)c1c(C)[nH]c(/C(C)=N/NC(=O)c2ccc3c(c2)OCO3)c1C 6684257 QFUHKFDSGLSJMJ-CIAFOILYSA-N 371.393 2.691 50 40 FFGB CCOC(=O)NNC(=O)CSc1cc(C(F)(F)F)cc(Cl)n1 91696115 CVNBJYBDKPVZQU-UHFFFAOYSA-N 357.741 2.623 50 40 FFGB COc1ccc(OCC(=O)NNC(=O)/C=C/c2ccc(Cl)cc2)cc1 14833614 LYTCPLYRNPINTQ-NYYWCZLTSA-N 360.797 2.588 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)cc1OC 5480009 DIHNLBWFVBRXET-FYJGNVAPSA-N 372.421 2.804 50 40 FFGB CCOC(=O)N/N=C(/C)c1ccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 100033903 OATKSAVZVHIREP-XLOQWRIGSA-N 357.410 2.836 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc(OC)cc2OC)cc1 12062018 RJGNKKSFUTYVNT-FOWTUZBSSA-N 374.418 2.963 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(C)c(C)c2)c1C 58913962 COOSKTNLLFRBCH-QRVIBDJDSA-N 366.465 2.853 50 40 FFGB O=C(N/N=c1/c(=O)c2cccc3cccc1c32)c1cc(-c2ccccc2)n[nH]1 5695191 RMXIKRBFEUXBSD-LKUDQCMESA-N 366.380 2.865 50 40 FFGB COc1cc(N2CCCC2)c(OC)cc1/C=N\NC(=O)c1cccc(O)c1 409094360 DIQWONXEAHCACU-BKUYFWCQSA-N 369.421 2.774 50 40 FFGB Cc1ccc(-n2c(SCC(=O)NN)nnc2-c2ccc(Cl)cc2)cc1 36724690 RCQBNEPADSUTKS-UHFFFAOYSA-N 373.869 2.978 50 40 FFGB COc1cc(Br)cc(/C=N\NC(=O)c2ccc(C)nc2)c1O 30803108 SJGUVWAVIWBPLN-LSCVHKIXSA-N 364.199 2.631 50 40 FFGB COc1ccc(-c2nc3cc(C(=O)NN)ccc3o2)cc1Br 226317607 PTWRRWXCMCPWRV-UHFFFAOYSA-N 362.183 2.869 50 40 FFGB CC1=C(C#N)[C@H](c2cc3c(cc2[N+](=O)[O-])OCO3)C2=C(CCCC2=O)N1 19805629 TTWLFCAICXEYTA-KRWDZBQOSA-N 353.334 2.815 50 40 FFGB CN(C)N(C(=O)c1cccc(Oc2ccccc2)c1)[C@H]1CCS(=O)(=O)C1 5298365 JWHNBLNIKYBPPK-INIZCTEOSA-N 374.462 2.585 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1cccn1-c1ccc(C(=O)O)cc1 9886596 CSBORRFBRBRJAU-FYJGNVAPSA-N 363.373 2.948 50 40 FFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(Br)o1 106373587 RCUXDKSLTRGAND-VIZOYTHASA-N 368.143 2.723 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c(OC)c2)cc1 408798562 VSXGNEMSQALDHM-NTEUORMPSA-N 352.346 2.733 50 40 FFGB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCCCCl)cc1OC 3899939 NSAXSRFYNKWWNX-OAHLLOKOSA-N 368.817 2.504 50 40 FFGB COc1cc(/C=N/NC(=O)c2cc(C)oc2C)cc(OC)c1OC(C)=O 1476656 LKQABMAPIJPDNU-DJKKODMXSA-N 360.366 2.603 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)c1cc2c(s1)CCCCC2 3430699 ANHZYNULNUTIJS-UHFFFAOYSA-N 374.462 2.866 50 40 FFGB OC[C@H](I)C[C@@](F)(OC(F)(F)F)C(F)(F)F 4290065 KPABQJYHRYTITM-QWWZWVQMSA-N 370.002 2.937 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2OCC)cc1 7869690 YEUZZOSMXNUAKZ-KGENOOAVSA-N 367.405 2.739 50 40 FFGB Cn1/c(=N\NC(=O)c2ccc(NC(=O)C3CC3)cc2)sc2ccccc21 102270632 NUBBLJFXTWHCEH-ZBJSNUHESA-N 366.446 2.834 50 40 FFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C/c1ccc(SC)cc1 59444418 WOCRGQBDPFAPMQ-YBFXNURJSA-N 357.435 2.814 50 40 FFGB O=C(NNC(=O)c1ccccc1F)c1ccc(CN2CCCCC2)cc1 26972230 YDHNYODXUIXJSC-UHFFFAOYSA-N 355.413 2.886 50 40 FFGB CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2ccccc2C(=O)OC)C1=O 9421890 ITPAREVYHFKBMX-COOUDCDJSA-N 367.405 2.776 50 40 FFGB Cc1ccc(C(=O)NNS(=O)(=O)c2ccc3c4c(cccc24)CC3)cc1 226861208 LHGYYCVBPUFLFS-UHFFFAOYSA-N 366.442 2.870 50 40 FFGB Cc1nc2ccccc2n1CC(=O)N/N=C/c1ccc(Br)o1 5571450 ZLANQHHDVCWCQP-CAOOACKPSA-N 361.199 2.851 50 40 FFGB COc1ccc(N[C@H](C)C(=O)N/N=C(\C)c2ccc([N+](=O)[O-])cc2)cc1 662803 MCZJXCZTDMPGGW-HMHKGCENSA-N 356.382 2.944 50 40 FFGB CCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(NC(C)=O)cc2)C1=O 9305928 ZFAODAPQHUZZTI-BOPFTXTBSA-N 352.394 2.560 50 40 FFGB C/C(=N\NC(=O)CSc1ncccn1)c1ccc(Br)cc1 408732729 XZXDJFNASXDUHE-VCHYOVAHSA-N 365.256 2.872 50 40 FFGB Cc1cc([N+](=O)[O-])nn1Cc1ccc(C(=O)N/N=C/c2ccccc2)cc1 2325768 CVCNJCADBZWJGQ-UDWIEESQSA-N 363.377 2.912 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(Br)o2)n1 8336687 OVOUGDMRYPYTSM-GIDUJCDVSA-N 369.244 2.691 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2cc(OC)ccc2OC)cc1 102724160 IXKGTBGXFAGHAR-VBKFSLOCSA-N 374.418 2.963 50 40 FFGB COC(=O)C1=C(CBr)N(C2CC2)C(=O)N[C@H]1c1ccccc1 10223723 JBKGWKWOZKGXQM-AWEZNQCLSA-N 365.227 2.737 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc3c(c2)OCO3)cc1 102713981 JYFMLGYYGLOPEB-XNTDXEJSSA-N 358.375 2.675 50 40 FFGB CC(C)(C)OC(=O)NNC(=O)COc1ccc(C(=O)c2ccccc2)cc1 12865772 JTESPRVXPMWHIY-UHFFFAOYSA-N 370.405 2.852 50 40 FFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)Nc2cccc(OC)c2)cc1 408796907 PRXHKMQZWNLNSJ-XNTDXEJSSA-N 366.373 2.793 50 40 FFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@@H](c1cccs1)C(C#N)=C(N)O2 1263963 HEIMWOLXZMZGBF-BLLLJJGKSA-N 369.446 2.615 50 40 FFGB O=C(CSc1nc2ccccc2s1)NNC(=O)c1ccccc1F 3326092 MVHFVOKGQVIGOX-UHFFFAOYSA-N 361.423 2.989 50 40 FFGB O=C(O)c1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 3470679 VHPIDRVIYQWGDV-HZHRSRAPSA-N 374.396 2.771 50 40 FFGB Cc1sc2ncn(CC(=O)N/N=C\C=C\c3ccccc3)c(=O)c2c1C 16729643 QTHUPJBDDQBOSK-VMGASSTCSA-N 366.446 2.890 50 40 FFGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccccc1C(=O)O 110086089 DKQKBQPWBCWRDP-SSDVNMTOSA-N 373.368 2.649 50 40 FFGB CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NNC(=O)CC(C)C 100135998 VXHLKPHEZLUQRO-WJDWOHSUSA-N 371.466 2.960 50 40 FFGB COc1ccc(Nc2nnc(SCC(=O)/C(C#N)=C(/C)N)s2)cc1 104722762 FWWXCCIRJFTCQL-XFXZXTDPSA-N 361.452 2.708 50 40 FFGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccccc1[N+](=O)[O-] 110478035 BMZJGLQGIDNQCZ-SRZZPIQSSA-N 374.356 2.859 50 40 FFGB CCN(CC)c1ccc([C@@H]2C(C#N)=C(O)NC(=O)[C@H]2[n+]2ccccc2)cc1 4561439 ZAGUSYJLZUEAIH-MOPGFXCFSA-O 363.441 2.568 50 40 FFGB C/C(=N\NC(=O)CCC(=O)Nc1cc(C)ccc1C)c1ccc(O)cc1O 96610932 IQKUTJGWFRLNRF-HYARGMPZSA-N 369.421 2.974 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C\N2CCN(c3ccccc3)CC2)cc1 32021071 DTKQRYHPMFWIJY-MSUUIHNZSA-N 362.433 2.863 50 40 FFGB O=C(COC(=O)c1cc(Cl)ccc1Cl)NNC(=O)c1cccs1 6528219 OILSOQXKKCTLDV-UHFFFAOYSA-N 373.217 2.673 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)c1 6685738 GSEIMAFWQSJRQD-UDWIEESQSA-N 358.394 2.875 50 40 FFGB COc1cc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc(OC)c1O 2343434 IKIITIWJBOHPED-KEBDBYFISA-N 358.394 2.555 50 40 FFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\NNC(=O)c1ccccc1O 16160692 LHLYPHNRJNHHSQ-GDNBJRDFSA-N 370.796 2.587 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)NNCC(=O)Nc2cccc(F)c2)c1 6566273 KPMHXVVJKCYCRV-UHFFFAOYSA-N 373.428 2.896 50 40 FFGB C/C(=N\NC(=O)C(=O)N/N=C(\C)c1ccc(C)s1)c1ccc(C)s1 5942785 FDOSUYRIYPHGQM-JYFOCSDGSA-N 362.480 2.807 50 40 FFGB CNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1Nc1cc(C)ccc1C 408709066 WVQXZQDGAAEKES-UFFVCSGVSA-N 358.829 2.897 50 40 FFGB O=C(NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1)C1CCCC1 84603593 BXZQPNHLKDEIIQ-CQSZACIVSA-N 372.494 2.850 50 40 FFGB CCN(CC)c1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c(OC)c1 409204599 AYMBBSWABMHOEH-QIPHDZALSA-N 357.454 2.744 50 40 FFGB C=CCn1c(SCC(=O)/C(C#N)=C(/C)N)nnc1-c1ccc(F)cc1 104783820 INOFRAASIDQZCM-KAMYIIQDSA-N 357.414 2.688 50 40 FFGB CCOc1cc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)ccc1OC 408724625 ALVPNKOZPLSYPT-XDHOZWIPSA-N 357.366 2.695 50 40 FFGB Cc1ccc(NC(=O)COc2cccc(/C=N/NC(=O)CC#N)c2)cc1C 409009432 FSQDLFADQRFDAI-WSDLNYQXSA-N 364.405 2.685 50 40 FFGB O=C(NNc1ccc([N+](=O)[O-])cc1)NC1CCN(Cc2ccccc2)CC1 32779422 YVXNNNMOXNEVFY-UHFFFAOYSA-N 369.425 2.886 50 40 FFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccccc1O)c1ccccc1 408978735 JPAGAUWMPSTTFX-RBYWHNRPSA-N 355.394 2.720 50 40 FFGB O=C(Cc1ccc(Br)cc1)N/N=C\c1ccc2c(c1)OCO2 36144785 SZCFLQWMXKMXRC-NVMNQCDNSA-N 361.195 2.871 50 40 FFGB Cc1ccc(S[C@@H](C)C(=O)N/N=C2/C(=O)N(C)c3ccccc32)cc1 409339315 TYZNNTKOXUDLBZ-XXADUYMVSA-N 353.447 2.973 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2)cc1 7869688 BCPGUZUGYCVIFO-LPYMAVHISA-N 371.824 2.671 50 40 FFGB COc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)cc1OC 59444037 VSSHEYQECUAWOS-KEBDBYFISA-N 352.394 2.732 50 40 FFGB CCc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc(F)cc3)CC2=O)cc1 725272 OUIKQSWAVQBGJY-LTNVFZTJSA-N 353.397 2.891 50 40 FFGB CCCC1=C(C(=O)OCC)[C@H](c2ccc3c(c2)OCO3)C(C#N)=C(N)O1 1227799 AUHHMDSUSFDJFN-MRXNPFEDSA-N 356.378 2.840 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cc(Br)ccc1O 1458012 UYPOGDSVSGDDEO-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CCOC(=O)C1=C(C)NC(S)=C(C#N)[C@H]1c1ccc(C(=O)OC)cc1 20528822 XEGJTOXZQINUOM-OAHLLOKOSA-N 358.419 2.662 50 40 FFGB C/C=C/C=N/NC(=O)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 409333701 IJCOJCNRPGIDON-VIZUIFFYSA-N 361.442 2.775 50 40 FFGB CCn1ncc(/C=N/NC(=O)c2ccc(Cn3cc(Cl)cn3)cc2)c1F 252485451 GVWNZNAJVDAKKS-IFRROFPPSA-N 374.807 2.704 50 40 FFGB CCn1ncc(/C=N/NC(=O)c2cc(-c3ccc(Cl)cc3)[nH]n2)c1F 252510713 ZOUGBBDKDPZIBK-UFWORHAWSA-N 360.780 2.850 50 40 FFGB NC(=O)c1cc2c(ccc3ccccc32)o/c1=N\NC(=O)c1ccccc1 12437871 INHMEOGDACAECR-FLFQWRMESA-N 357.369 2.931 50 40 FFGB CC(C)NC(=O)CC(=O)N/N=C/c1ccccc1OCc1ccccc1 5381060 WDEFYOUUJIHAFN-FYJGNVAPSA-N 353.422 2.630 50 40 FFGB N#CC1=C(N)N2C(=C(C#N)[C@]13C(=O)Nc1ccccc13)Sc1ccccc12 49947100 MQEURGSJMMOHFH-HXUWFJFHSA-N 369.409 2.931 50 40 FFGB CCc1c(C(=O)NNC(=O)[C@H]2CC(C)=C(C)C[C@@H]2C(=O)O)csc1C 2765296 ZQPZNPVQFAMIRN-KBPBESRZSA-N 364.467 2.827 50 40 FFGB CCOc1cc2c(cc1/C=N/NC(=O)Cc1ccc(OC)cc1)OCO2 409102061 XSEFONFTRKXLHM-RGVLZGJSSA-N 356.378 2.515 50 40 FFGB CCOc1ccc(OC)c(/C=N/NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 662858 ZLBYELUMKQUIOD-YBFXNURJSA-N 373.365 2.531 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1ccc(F)cc1 100522745 PAODQZVRHDXLQH-WSDLNYQXSA-N 371.368 2.731 50 40 FFGB CC(C)c1n[nH]c(S[C@H](C)C(=O)NNC(=O)c2cccc(Cl)c2)n1 9336045 YWGJGHFLBWXYFZ-SECBINFHSA-N 367.862 2.523 50 40 FFGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccc(OC)cc1 15423079 WKVIJNNZKOLNDW-ZDUSSCGKSA-N 357.248 2.704 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2ccc(C)cc2)cc1 4697755 BOMXMCSMMKIFTK-PXLXIMEGSA-N 353.422 2.816 50 40 FFGB COc1cccc(NC(=S)NNC(=O)c2ccc(OC(F)F)cc2)c1 652839 UPNARYUGBFZURL-UHFFFAOYSA-N 367.377 2.928 50 40 FFGB COC(=O)CNc1ccccc1C(=O)/C(C#N)=C1/Nc2ccccc2N1C 12536983 HSZQJOYTTVSMAQ-ZHZULCJRSA-N 362.389 2.751 50 40 FFGB C/C(=N\NC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1)c1cccc(O)c1 13656219 GJLAOYDFVJKKSQ-YBFXNURJSA-N 365.349 2.845 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2cccc(C)c2)c1C 408944822 VRFWDQGRTJOOMQ-OMBDHMDGSA-N 354.454 2.767 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2cccc([N+](=O)[O-])c2)c(OC)c1 408870870 VWKRSMASSSIJGL-OVCLIPMQSA-N 367.361 2.835 50 40 FFGB COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCOCC3)c2C)cc1 6961760 OPEKSEODGUUNRB-AQTBWJFISA-N 365.433 2.869 50 40 FFGB COc1ccc(/C=N/NC(=O)C(C)(C)O)cc1OCc1cccc(C)c1 32578380 QLDHMNVKEXQSAE-CIAFOILYSA-N 356.422 2.804 50 40 FFGB COc1ccc(OCC(=O)N/N=C(\C)c2ccc(-n3ccnc3)cc2)cc1 5071422 ZPNIUPQYJKSRBU-PXLXIMEGSA-N 364.405 2.800 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)cc1 408771924 JCBLQQPHAQCHIZ-UDWIEESQSA-N 373.478 2.528 50 40 FFGB O=C(CNc1ccc(Br)cc1)N/N=C/c1ccc([N+](=O)[O-])o1 409362381 VCIVUEORKCMBEU-FRKPEAEDSA-N 367.159 2.513 50 40 FFGB COc1ccc(CC(=O)N/N=C/c2cn(C)c3ccccc23)cc1OC 6268839 CCDRUFZGCMZBMX-CIAFOILYSA-N 351.406 2.888 50 40 FFGB C[C@](O)(CBr)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 13581035 JSZFXNCCDXABCT-NSHDSACASA-N 351.122 2.661 50 40 FFGB in-vitro C/C(N)=C(\C#N)C(=O)CSc1nnc(-c2ccc(OC(F)F)cc2)o1 104880566 WNZVJJZXFLAOLS-FLIBITNWSA-N 366.349 2.755 50 40 FFGB COC(=O)[C@@](O)([C@@H](Cl)C(=O)Nc1cccc(Cl)c1C)C(F)(F)F 2115271 KFKCVTWBLHBRMR-CABZTGNLSA-N 374.142 2.661 50 40 FFGB C/C(=N\NC(=O)CCC(=O)NCc1ccccc1)c1ccc([N+](=O)[O-])cc1 13070477 PMKRWOYVEVMTDE-KGENOOAVSA-N 368.393 2.532 50 40 FFGB Cc1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1 6944580 CJGBSWKVSNGZEQ-GFCCVEGCSA-N 364.492 2.805 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(OC)c([N+](=O)[O-])c2)cc1 409331982 IZFXRBBJLROFQD-XDHOZWIPSA-N 357.366 2.695 50 40 FFGB O=C(N/N=C/c1cccc2ccccc12)C(=O)Nc1ccc2c(c1)OCO2 409001751 KAAVXOHMMVELGK-SRZZPIQSSA-N 361.357 2.657 50 40 FFGB CCOC(=O)c1cccc(-n2c(C)cc(/C=N/NC(=O)CC#N)c2C)c1 59197370 POCWMJKNQSGEOF-CIAFOILYSA-N 352.394 2.635 50 40 FFGB C/C(CC(=O)Nc1cccc(C)n1)=N\NC(=O)COc1cc(C)cc(C)c1 4409152 AHKXFULOUCUHNT-XQNSMLJCSA-N 368.437 2.907 50 40 FFGB COC(=O)c1ccc(N/C=C2\C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)cc1 8990536 PAXIHTRUWNIXJS-YVLHZVERSA-N 367.405 2.634 50 40 FFGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCCO2)c1nnc2n1CCCCC2 97259108 FIPOJTLZMNFVOH-MDWZMJQESA-N 367.365 2.748 50 40 FFGB Cc1cc2c(c(=O)[nH]1)[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1480493 QQTHHGGEFMOCQE-CYBMUJFWSA-N 358.195 2.664 50 40 FFGB Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C/c1ccc2c(c1)OCCO2 6825979 HKTBRHIALCDSKC-KEBDBYFISA-N 373.796 2.508 50 40 FFGB O=C(N/N=C/c1cc(Br)c(N2CCCC2)o1)c1ccccn1 59302573 OBCCJVOOYXHPTD-VCHYOVAHSA-N 363.215 2.801 50 40 FFGB COc1cc(/C=N/NC(=O)COc2c(C)cccc2C)cc(OC)c1O 2397123 JHDGVWVIQONBPE-KEBDBYFISA-N 358.394 2.555 50 40 FFGB CCO[C@@H](C)n1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253396848 FBWOQDNOLOKQAK-MEDUHNTESA-N 356.426 2.889 50 40 FFGB CCc1ccc(CN(C)[C@H](C)C(=O)NNC(=O)c2ccc(F)cc2)cc1 8328160 VEJVJWWYGXMVDT-CQSZACIVSA-N 357.429 2.670 50 40 FFGB CCO/C=N\C1=C(C#N)SC2=N/C(=C/c3ccc(OC)cc3)C(=O)N21 104316378 QWXSUNLIDKDWMQ-HSYVKLNESA-N 354.391 2.739 50 40 FFGB O=C1NC[C@H](c2ccccc2)[C@@H]1C(=O)N/N=C/c1ccc2ccccc2c1 4322474 URMMYKMQBMBWSI-ATWZLJBJSA-N 357.413 2.820 50 40 FFGB C/C(CCc1ccccc1)=N/NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 4646918 XHVXRWCPIUIUDQ-MOSHPQCFSA-N 354.366 2.658 50 40 FFGB N#CC1=C(S)N(c2ccccc2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC1=O 9111552 YPMMNRNKQVSJHB-HNNXBMFYSA-N 352.375 2.895 50 40 FFGB COc1cc(/C=N\NC(=O)Cc2cccs2)cc(Br)c1O 30721753 APQBPPHIJHIFCQ-PXNMLYILSA-N 369.240 2.918 50 40 FFGB Cc1ccc(OCC(=O)N/N=C/c2cc([N+](=O)[O-])cc(C)c2O)cc1C 36245429 GXUPRBNRUSKRNS-DJKKODMXSA-N 357.366 2.755 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)cc1 3658259 MAWWLVGRNAKBIY-WSDLNYQXSA-N 371.824 2.671 50 40 FFGB COc1ccc(/C=N/NC(=O)CN2CCCc3ccccc32)c(OC)c1 3202162 VDEGVLXBYCQPAV-FYJGNVAPSA-N 353.422 2.607 50 40 FFGB Cc1c(C(=O)NNC(=O)c2cc3ccccc3cc2O)cccc1[N+](=O)[O-] 2782735 RDIXSVLEYVMFCY-UHFFFAOYSA-N 365.345 2.837 50 40 FFGB COc1ccccc1Cn1c(=O)c2ccccc2n2c(CCl)nnc12 408712713 KDSMCPUSMQAXFO-UHFFFAOYSA-N 354.797 2.840 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc(NC(C)=O)cc2)cc1 102673291 LQNZRLAGUNVKSW-PDGQHHTCSA-N 371.418 2.904 50 40 FFGB CCOc1ccc(/C=N/NC(=O)COc2ccccc2OCC)c(O)c1 2743143 NMQYHOZYGSDRQU-UDWIEESQSA-N 358.394 2.719 50 40 FFGB Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C/c2ccc3c(c2)OCO3)c1 2132285 UWPCABJVZGSVSG-SRZZPIQSSA-N 367.405 2.901 50 40 FFGB CCCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2ccccc2C)c2ccccc21 5324653 WZMMTLLUMJMEQC-HNENSFHCSA-N 372.428 2.946 50 40 FFGB C/C(=N\NC(=O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2oc1=O 4738448 KRNSWEKBTTUMQG-YBFXNURJSA-N 351.318 2.855 50 40 FFGB O=C(N/N=C\c1ccc(I)o1)c1ccc(F)cc1 4813986 MCABDMNGBFMREI-CHHVJCJISA-N 358.110 2.787 50 40 FFGB Cc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 409069585 LQWYPXDBIKREPT-DEDYPNTBSA-N 368.393 2.504 50 40 FFGB COc1ccc(/C=N\NC(=O)c2cnccn2)cc1OCc1ccccc1 100313621 RMODNURCGXRUGE-FMCGGJTJSA-N 362.389 2.828 50 40 FFGB O=C(CSc1nc2ccc(Cl)cc2[nH]1)NNC(=O)c1ccccc1 4406665 STVGMKXONJVLAD-UHFFFAOYSA-N 360.826 2.770 50 40 FFGB C/C(=N\NC(=O)c1ccc(C(=O)N/N=C(\C)c2ccco2)o1)c1ccco1 654722 NXIIFFNOFFTBRV-AYKLPDECSA-N 368.349 2.774 50 40 FFGB COc1ccc(Br)cc1C1C(C#N)=C(N)SC(N)=C1C#N 20436308 UJPRYUAPCSPYLO-UHFFFAOYSA-N 363.240 2.676 50 40 FFGB COc1ccc(OC)c([C@@H]2CCCN2C(=O)NNC(=O)c2ccccc2)c1 53954802 LBYKTYABWSXFFG-KRWDZBQOSA-N 369.421 2.895 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)Nc2ccccc2OCC)c1 58884843 KXLAMTKPMMRMSL-KGENOOAVSA-N 367.405 2.739 50 40 FFGB NNC(=O)c1c(N)n(-c2ccc3ccccc3c2)c2nc3ccccc3nc12 3193681 IEULGWKQOPSWJG-UHFFFAOYSA-N 368.400 2.913 50 40 FFGB O=C(CN1CCCCC1)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 408859358 SSJLYSISLPBGTQ-XDHOZWIPSA-N 356.382 2.791 50 40 FFGB COc1cc(C(=O)N/N=C/c2ccc(N(C)C)cc2)cc(OC)c1OC 1727235 FOIRZUYWMMVDEI-UDWIEESQSA-N 357.410 2.542 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)CNc2ccc(C)c(C)c2)c2ccccc21 6630238 GDPSGZNWFSDVTH-FCDQGJHFSA-N 350.422 2.602 50 40 FFGB COc1cc(/C=N/NC(=O)[C@H](OC)c2ccccc2)cc(OC)c1OC 20228229 HXKAPCCIELFOMH-XNHPLOEXSA-N 358.394 2.550 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)c2cnc(Cl)c(Cl)c2)c1 3361741 BIWJDAYCGYEQMH-UHFFFAOYSA-N 354.193 2.537 50 40 FFGB Cc1ccc(-c2noc(CCC(=O)NNc3nc(C)cc(C)n3)n2)cc1 14513961 VVFXXBNBDUKBNU-UHFFFAOYSA-N 352.398 2.528 50 40 FFGB Cc1ccc(NCC(=O)NNC(=O)c2cccnc2SC(F)F)cc1 8710404 FLIJZUDDJPKJNF-UHFFFAOYSA-N 366.393 2.578 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(OC)cc1C 408606117 OEQLCSQSVZGRMH-OAHLLOKOSA-N 370.434 2.562 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c1 409184011 HTOCFQGLPDBJJA-YBFXNURJSA-N 356.451 2.901 50 40 FFGB C[C@@H]1CCCN([C@H](C)CNS(=O)(=O)c2ccc(CCCl)cc2)C1 195529457 VZJLUSYXSDJNMO-HUUCEWRRSA-N 358.935 2.867 50 40 FFGB CNC(=O)/C(C#N)=C/c1c(Oc2ccc(C)cc2)nc2c(C)cccn2c1=O 2403826 XLBQXXNYLPNVBT-RVDMUPIBSA-N 374.400 2.757 50 40 FFGB N#CC1=C(N)Oc2oc3ccccc3c(=O)c2[C@H]1c1ccc([N+](=O)[O-])cc1 1073561 YBDNLXDMMWOWFH-HNNXBMFYSA-N 361.313 2.919 50 40 FFGB O=[N+]([O-])C1=C([N+](=O)[O-])[C@H](S[C@H]2[C@H]3CC[C@@H](C3)[C@H]2Br)C=C1 104100553 HSONDIAAORAILM-HIBIETOASA-N 361.217 2.985 50 40 FFGB O=C(CCc1ccccc1Cl)NNC(=O)COc1ccc(F)cc1 8852447 GBTVPJYVSJQGGH-UHFFFAOYSA-N 350.777 2.638 50 40 FFGB CCOc1cc(C(=O)N/N=C\c2ccc(OC)c(OC)c2)ccc1OC 409313834 QZWZZBNPPMIGJE-NDENLUEZSA-N 358.394 2.875 50 40 FFGB C[C@@H](Cl)C(=O)NCCNC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 65549734 SOVWOOFLXAHZIV-NXEZZACHSA-N 365.783 2.809 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(Cl)cc3)CC2=O)cc1 33338154 UVCTUJUQMPLIHN-WHJAWBAWSA-N 371.824 2.852 50 40 FFGB O=C(CCl)Nc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 1723196 JABAJYSTIGQAFU-UHFFFAOYSA-N 354.771 2.605 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)c3c(F)cccc3F)ccc21 29507109 WFJYMDCINPHNQK-UHFFFAOYSA-N 358.348 2.718 50 40 FFGB O=C(N/N=C/c1ccccn1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 59459746 FUAPFAFUWFSHNT-ODCIPOBUSA-N 370.718 2.843 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)cc1Cl 5515198 BSQKUUGQCBQAMB-UHFFFAOYSA-N 369.204 2.842 50 40 FFGB O=C(N/N=C/c1cc(O)ccc1[N+](=O)[O-])c1ccc(N2CCCC2)cc1 408677563 RWXFKJJIQVESQU-XDHOZWIPSA-N 354.366 2.665 50 40 FFGB O=C(N/N=C1/C(=O)N(CN2CCCCCC2)c2ccccc21)c1ccco1 102647238 PNJSYXSDIIUSPG-DYTRJAOYSA-N 366.421 2.594 50 40 FFGB Cc1cc2cccc(C)c2nc1SCC(=O)NNC(=O)c1ccco1 932896 AUSKUINCLGCDKS-UHFFFAOYSA-N 355.419 2.998 50 40 FFGB Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1ccc(N(C)C)cc1 59515554 SOSNLMQYMHFUJK-RGVLZGJSSA-N 358.829 2.803 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1ccccc1C(=O)c1ccc(C)cc1 103111556 IQTQJTWEWSRZRC-JXAWBTAJSA-N 362.385 2.708 50 40 FFGB CCOC(=O)C1=C(c2cccs2)OC(N)=C(C#N)[C@@H]1c1cccnc1 2358749 XRSWYJFUYNRFOP-AWEZNQCLSA-N 353.403 2.925 50 40 FFGB CCc1sc(C(=O)NNC(=O)c2cncc(Br)c2)cc1C 6603027 VKTYTXPJHDFRHS-UHFFFAOYSA-N 368.256 2.851 50 40 FFGB O=C(O)COc1cccc(/C=N/NC(=O)c2ccccc2-n2cccc2)c1 408748382 CUSWUTJVRZIYIY-FYJGNVAPSA-N 363.373 2.705 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)cc1 5527035 CQIZMDVLXLYKDY-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB Cc1ccc([C@@H]2CC(=O)NC(SCC(=O)NCC(C)C)=C2C#N)cc1 6477552 UEHUPUIDVCJCFM-HNNXBMFYSA-N 357.479 2.839 50 40 FFGB COC(=O)c1ccc(/C=C/C(=O)NNC(=O)c2ccccc2Cl)cc1 23042767 GGGMOEOBOSAKJR-DHZHZOJOSA-N 358.781 2.601 50 40 FFGB N#CC(=C/c1ccco1)/C(O)=N/S(=O)(=O)Cc1ccc(Cl)nc1 58151899 YJDIIQOFWGRLRQ-WDZFZDKYSA-N 351.771 2.721 50 40 FFGB COc1cc(/C=C(/C#N)C(N)=S)ccc1OS(=O)(=O)c1ccccc1 408542865 LLMJVWPCNHMVNK-LCYFTJDESA-N 374.443 2.656 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)c(OC)c1 408875932 MLUIWVANLHJKLK-VIZOYTHASA-N 366.373 2.656 50 40 FFGB O=C(N/N=C/c1ccccc1Br)[C@@H]1COc2ccccc2O1 3475686 SHOXDCHLGQEJMG-UPAIAECRSA-N 361.195 2.739 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@H]1c1ccc2c(c1)OCO2 4772343 HUTQKRGXCYIZJB-INIZCTEOSA-N 372.336 2.556 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 7869662 BNYLRDYLBSKUGD-FYJGNVAPSA-N 351.406 2.957 50 40 FFGB COc1ccc(C(=O)NNC(=O)c2cccc3ccccc23)cc1OC 840328 GWDBDNLXIFGDNV-UHFFFAOYSA-N 350.374 2.932 50 40 FFGB O=C(N/N=C/c1ccccc1Cl)c1ccc(CN2CCOCC2)cc1 23382552 MGHYAJWXYHZYMR-FYJGNVAPSA-N 357.841 2.936 50 40 FFGB O=C(O)CC1(CC(=O)NNC(=O)c2ccccc2Cl)CCCCC1 24151142 DRAXXCKMOGMONP-UHFFFAOYSA-N 352.818 2.916 50 40 FFGB CCC[C@@H](C(=O)OCC)/C(C)=N\NC(=O)Cc1ccc(OC)c(OC)c1 4776293 OACSLLZNVGIOJH-CTFRJJSNSA-N 364.442 2.718 50 40 FFGB Cc1nn(C)c(F)c1/C=N/NC(=O)Cn1c2c(c3ccccc31)CCCC2 252509178 YESFSZNTMPUFEE-SSDVNMTOSA-N 367.428 2.851 50 40 FFGB CC(C)COc1ccc(C(=O)NNC(=O)Cn2cnc3ccccc32)cc1 3276681 ZFAXRZMKYRUWCP-UHFFFAOYSA-N 366.421 2.532 50 40 FFGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)Cn1cnc3ccsc3c1=O)C2 58368827 YHTJEAIPEKUTOI-WNVVWFCKSA-N 358.467 2.776 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)c2cc3c(OC)cccc3[nH]2)c1 2357003 QNSTVLIOMAQVAA-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB N#C/C(=C\c1ccc(OC(=O)c2ccccc2)cc1)C(=O)N1CCOCC1 408767115 VXCIHVVKUOWBOY-NBVRZTHBSA-N 362.385 2.672 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2ccc(I)o2)cc1 6211405 MGRCVKXZMXWESF-OVCLIPMQSA-N 354.147 2.957 50 40 FFGB O=C(N/N=C/c1ccc(F)cc1)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 2290676 ZRPLVMFVMPGIQM-WVISFHDSSA-N 359.788 2.982 50 40 FFGB C/C(CCc1ccccc1)=N\NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 13882096 XHVXRWCPIUIUDQ-DEDYPNTBSA-N 354.366 2.658 50 40 FFGB CCOc1ccccc1OCC(=O)NNC(=O)c1cc2c(s1)CCCC2 6789546 FOFMBMDBYRHEEG-UHFFFAOYSA-N 374.462 2.866 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O)c1ccccc1 408777964 NEFACIXUEHAQRL-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB COC(=O)NC(C#N)=C(NCCc1ccccc1)NCCc1ccccc1 72238504 HZVAKUFHFZFQBE-UHFFFAOYSA-N 364.449 2.700 50 40 FFGB CCCc1n[nH]c2c1[C@@H](c1c(OC)cc(OC)cc1OC)C(C#N)=C(N)O2 4755499 XNZVZACVZNCWEI-HNNXBMFYSA-N 370.409 2.606 50 40 FFGB O=CN(/C=C\NC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1 13406488 ZYWJIUGHHYWMLI-QXMHVHEDSA-N 369.377 2.684 50 40 FFGB COc1cc(OC)c2cc(C(=O)N/N=C/c3cccc(OC)c3O)[nH]c2c1 2212525 QJWYEFHYQOOGHV-KEBDBYFISA-N 369.377 2.663 50 40 FFGB COc1ccc(C)cc1CC(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C 12763074 TWASIHRAISRTFB-INIZCTEOSA-N 370.449 2.778 50 40 FFGB CC(C)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(O)c3)[C@H]2C1 4452844 PBMOQROQJMANGG-OALUTQOASA-N 359.433 2.526 50 40 FFGB Cc1ccc(C)c(CC(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)c1 409365173 QETWZOXBIVSLKO-DJKKODMXSA-N 355.350 2.633 50 40 FFGB COc1cccc([C@H]2[C@@H]3C(=C[C@H]4CC[C@@H]3N4C)C(C#N)=C(N)C2(C#N)C#N)c1 12371974 FECXSRCBUAIHFT-YGBSJELFSA-N 371.444 2.581 50 40 FFGB O=C(NCc1ccccc1)C(=O)N/N=C/c1cccc(Cl)c1Cl 408751825 CIWAMGIUHDUXRC-KEBDBYFISA-N 350.205 2.760 50 40 FFGB Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNC(=O)CC(C)C 32937169 HAJSEZHFJKJXBL-UHFFFAOYSA-N 362.861 2.879 50 40 FFGB CC[C@H](C(=O)N/N=C/c1ccc(F)s1)n1cc(Br)cn1 252487465 HWLHXCCLWFHCEG-UWJMNNEMSA-N 359.224 2.948 50 40 FFGB CCN(Cc1ccc2c(c1)OCCO2)C(=O)NNC(=O)c1ccc(C)cc1 32794920 ISANLOWWBXHSRW-UHFFFAOYSA-N 369.421 2.643 50 40 FFGB O=C(CN1C[C@@H](c2ccccc2)CC1=O)N/N=C/c1c[nH]c2ccccc12 408974173 WKXXEINZWGOSFX-PDYUXYPTSA-N 360.417 2.634 50 40 FFGB CCS(=O)(=O)[C@@H](Br)[C@@H](O)c1ccc(Br)cc1 96519075 BFGMUYFZUFDMEZ-VHSXEESVSA-N 372.078 2.638 50 40 FFGB O=S(=O)(OCCCl)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F 1083812557 RZVWCLZXFXODJO-UHFFFAOYSA-N 362.597 2.997 50 40 FFGB O=C(N/N=C/c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1ccncc1 5128160 PPFQITZIRZOWGS-SRZZPIQSSA-N 363.333 2.941 50 40 FFGB CC(C)N1C(=O)/C(=N\NC(=O)COc2ccc(Cl)cc2)c2ccccc21 5838058 HCEFGCDMAGKVQH-PYCFMQQDSA-N 371.824 2.994 50 40 FFGB CCOC(=O)/C(C#N)=C\c1ccccc1OS(=O)(=O)c1ccccc1 58822738 YBCIBIFCCFAUCU-QINSGFPZSA-N 357.387 2.924 50 40 FFGB CCOC(=O)NNC(=O)c1sc2nc(-c3ccco3)nc(C)c2c1C 32901015 LOFXHGQQIKOBPY-UHFFFAOYSA-N 360.395 2.959 50 40 FFGB O=C(CCl)N1CCc2c([nH]c3ccccc23)[C@@]12C(=O)Nc1ccccc12 20636504 BUAQTPBSVAXOSV-FQEVSTJZSA-N 365.820 2.987 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(C)cc2)c1C 59960442 AWINWHLKAMBVDG-XKZIYDEJSA-N 352.438 2.545 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1 14134470 ZHMVLJUPWWEWAY-CIAFOILYSA-N 374.824 2.975 50 40 FFGB Nc1ccc(C(=O)NN2C(=O)[C@H](Cl)[C@H]2c2ccccc2Cl)cc1 1633096 UREJEGPGLHQRMX-ZIAGYGMSSA-N 350.205 2.758 50 40 FFGB CCOC(=O)[C@@]1(C)c2[nH]c3ccc(OC)cc3c2CCN1C(=O)CCl 11692295 ORSGRBGGAGVKRN-GOSISDBHSA-N 364.829 2.578 50 40 FFGB N=C(N=P(c1ccccc1)(c1ccccc1)c1ccccc1)N[N+](=O)[O-] 104167555 AKQSZZAZGVATQO-UHFFFAOYSA-N 364.345 2.880 50 40 FFGB O=C(CSCc1cccc(Br)c1)NNC(=O)c1ccco1 9314575 GPFRUPZAACPZLM-UHFFFAOYSA-N 369.240 2.737 50 40 FFGB CCOc1cc(/C=N/NC(=O)CNC2CCCCC2)cc(Cl)c1O 409375521 LYWDDSJXCCXIQJ-KEBDBYFISA-N 353.850 2.817 50 40 FFGB O=C(CCc1ccccc1)N/N=C/c1ccc(I)o1 83317220 NBYQHGDQWOIDSP-MHWRWJLKSA-N 368.174 2.967 50 40 FFGB C/C(=N/NC(=O)c1ccncc1)c1ccc(I)cc1 777845 HDVNCKZBTVOGEJ-YVLHZVERSA-N 365.174 2.840 50 40 FFGB CO[C@@H](C(=O)NNC(=O)COc1ccc(Cl)cc1C)c1ccccc1 5724970 GXNGPOVXYYDHGK-QGZVFWFLSA-N 362.813 2.562 50 40 FFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)[C@H](OC)c2ccccc2)cc1 100923046 FORUNVDEJKXYOU-VZMFNRANSA-N 369.421 2.904 50 40 FFGB O=C(NNC(=O)c1cc2c(s1)CCCCCC2)c1ccc2[nH]nnc2c1 22024165 DYYQJBXVRXXDSM-UHFFFAOYSA-N 369.450 2.753 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] 408598655 HMDJWRNKLHQKRB-LICLKQGHSA-N 358.310 2.666 50 40 FFGB CC(C)(C)OC(=O)N1CC2(CC[C@@H](CI)O2)C1 307718806 LYGQZEWJUKSMPU-VIFPVBQESA-N 353.200 2.590 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(C)cc3)CC2=O)cc1 33907682 ZRUDTCNQWQGVLA-IXGURIBZSA-N 351.406 2.507 50 40 FFGB CC(=O)Nc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)cc1 8565998 HOVPDDZRQRTFMZ-CQSZACIVSA-N 351.410 2.884 50 40 FFGB Cc1ccc(/C=N/NC(=O)[C@]2(C)CC2(Br)Br)o1 2750945 MEDTUWQKBGNICA-ZFGNZVLRSA-N 364.037 2.934 50 40 FFGB N#C/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)C(=O)N1CCOCC1 843125 VJBQJYUKFOUQJV-ACCUITESSA-N 353.334 2.621 50 40 FFGB Cc1ccc(N(CC(=O)NN=C2CCCCC2)S(C)(=O)=O)cc1C 408782043 VISCDINDDYSUQC-UHFFFAOYSA-N 351.472 2.506 50 40 FFGB O=C(NNC(=O)C1(c2ccc(F)cc2)CC1)C1(c2ccc(F)cc2)CC1 40158867 CRLIFJWBJSHOSK-UHFFFAOYSA-N 356.372 2.876 50 40 FFGB Cc1cc(C)cc(N2C(=O)C[C@H](NNC(=O)c3ccc(Cl)cc3)C2=O)c1 2409114 LDEISLQNJQCYJJ-INIZCTEOSA-N 371.824 2.523 50 40 FFGB COc1cccc(OCC(=O)NNC(=O)c2ccc3ccccc3c2)c1 722540 SYEYGVUSIXUZSK-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB O=C(Cc1cccc2ccccc12)NNS(=O)(=O)c1cccc(F)c1 12817567 ZARINUORPIIWNB-UHFFFAOYSA-N 358.394 2.531 50 40 FFGB Cc1nccn1CCCNC(=O)NNc1ccc(OC(F)(F)F)cc1 78648345 XZWHFIRWSJEVAJ-UHFFFAOYSA-N 357.336 2.807 50 40 FFGB Cn1c(CC(=O)NNC(=O)c2ccc3ccccc3c2)nc2ccccc21 9865344 DUHFQCYVIVPUND-UHFFFAOYSA-N 358.401 2.730 50 40 FFGB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\NNC(=O)c1ccccc1O 14922312 DWFSQZCJCQMMKG-GDNBJRDFSA-N 370.796 2.587 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1cc(Br)c(C)o1 408827570 KQEMYBGBQDURGY-CAOOACKPSA-N 367.199 2.888 50 40 FFGB C[C@@H](Cn1cnc2ccccc21)C(=O)N/N=C\c1ccc([N+](=O)[O-])cc1 35188749 QSRZERWUFRYBJZ-NLLJVSSUSA-N 351.366 2.731 50 40 FFGB O=C(N/N=C\c1ccc2c(c1)OCO2)C(O)(c1ccccc1)c1ccccc1 31670114 KDQFQKZJQZEEKD-UCQKPKSFSA-N 374.396 2.802 50 40 FFGB Cc1cc(C(=O)NN)cc(C)c1OC(=O)c1ccccc1Br 256050283 DMBGOQRUJMGMBJ-UHFFFAOYSA-N 363.211 2.889 50 40 FFGB CC(C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)cc1 3067284 HYBALUJVRGZQSQ-SRZZPIQSSA-N 373.840 2.894 50 40 FFGB CC(=C/c1ccco1)/C=N/NC(=O)CN1CCN(Cc2ccccc2)CC1 22932975 LGRPCGDYYMASJQ-QWYLDISPSA-N 366.465 2.603 50 40 FFGB CN1C(=O)/C(=C\NNC(=O)c2cc3ccccc3cc2O)c2ccccc21 15885168 DIRKITSBUGFFBM-ATVHPVEESA-N 359.385 2.797 50 40 FFGB COC(=O)c1ccc([C@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC(C)(C)C)cc1 803890 XGTMGMYOCDBSGA-INIZCTEOSA-N 370.405 2.897 50 40 FFGB C[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1ccc(Br)cc1 3148216 BKTXMIHXSDLUDK-MKFNJMOCSA-N 374.238 2.718 50 40 FFGB O=C(NNC(=O)C1CC1)c1cn(Cc2ccccc2)nc1-c1cccs1 26967723 ZJXYYIKGKRQUCY-UHFFFAOYSA-N 366.446 2.831 50 40 FFGB CCc1ccccc1N(CC(=O)N/N=C(\C)c1ccccc1)S(C)(=O)=O 408785085 XMNOYXXMNJOBRW-HMMYKYKNSA-N 373.478 2.555 50 40 FFGB NC(=O)COc1ccc(/C=N\NC(=O)c2ccc(Cl)cc2)cc1Cl 409247009 APVRDWWBCAKGNV-ZBKNUEDVSA-N 366.204 2.621 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NCc2cccs2)cc(OC)c1OC 6180785 RKHHHTYUDWSTOZ-NTUHNPAUSA-N 358.419 2.997 50 40 FFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccc(C)cc2)nc2ccccn2c1=O 2435137 WTIXCEAZPDGHQP-NTCAYCPXSA-N 374.400 2.838 50 40 FFGB Cc1ccc(C(=O)N/N=C2\C(=O)N(CN3CCCC3)c3ccccc32)cc1 4952596 WPTXZWATCCKBKV-QOCHGBHMSA-N 362.433 2.529 50 40 FFGB COC(=O)c1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N(C)C)c2C)cc1 4705367 MSBYKPNXHQHOOT-GZTJUZNOSA-N 351.406 2.876 50 40 FFGB C/C(=N/NC(=O)CC1(C)SCCS1)c1ccc2c(c1)OCCO2 408592548 ZCUFPYZUUQVKCU-BOPFTXTBSA-N 352.481 2.884 50 40 FFGB N#C/C(=C\C1=Cc2ccccc2OC1)C(=O)NCc1ccc2c(c1)OCO2 409198468 GKBWZVNBXRTMRA-CAOOACKPSA-N 360.369 2.957 50 40 FFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1 409007630 YKRSIRSCEMJLBH-PXLXIMEGSA-N 365.433 2.698 50 40 FFGB O=C(N/N=C/c1cccc(C(F)(F)F)c1)[C@@H]1COc2ccccc2O1 3475554 QRAICSDSMJABTH-PZEXIZOFSA-N 350.296 2.996 50 40 FFGB NNC(=O)c1ccc(OCc2ccc([N+](=O)[O-])cc2)c(Br)c1 226345477 WTIABWFNDWKFDC-UHFFFAOYSA-N 366.171 2.540 50 40 FFGB CC(C)c1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1 5261827 GKHHOVDRWQGJQC-UHFFFAOYSA-N 371.462 2.925 50 40 FFGB C=CCn1c(=O)c(C(=O)N/N=C/c2cccc(F)c2)c(O)c2ccccc21 100534729 JXCKLJKHPQDWTD-WSDLNYQXSA-N 365.364 2.796 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc([N+](=O)[O-])c2)c1C 24223294 NYULWRCPFBVGSA-MHWRWJLKSA-N 368.393 2.672 50 40 FFGB Cc1ccccc1-n1ncc(C(=O)NNC(=O)c2ccccn2)c1C1CC1 29736206 ORWLUJOQKCOQQW-UHFFFAOYSA-N 361.405 2.528 50 40 FFGB Cc1ccc(S(=O)(=O)N2C=C[C@H]3C(=O)[C@@H](Br)CC[C@@H]32)cc1 6214188 BHBKROHWTGHOGA-RDBSUJKOSA-N 370.268 2.624 50 40 FFGB CCOc1cc2c(cc1CNS(=O)(=O)CCCCCl)O[C@H](C)C2 97163911 OWEAKMTTXOCKIJ-GFCCVEGCSA-N 361.891 2.847 50 40 FFGB COC(=O)COc1ccc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc1 409366627 XGRBTDIWBDSZEX-MTJSOVHGSA-N 354.406 2.548 50 40 FFGB Cc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccccc3O)CC2=O)cc1C 409164110 CLIAYZFOBQIBSN-XYHOIZSOSA-N 351.406 2.512 50 40 FFGB Cc1nn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1B(O)O 196785772 HBCQGNKMNRVLKJ-UHFFFAOYSA-N 368.245 2.712 50 40 FFGB CC(NCCN1C(=O)S/C(=C/c2ccc(C)cc2)C1=O)=C(C#N)C#N 6908775 JNTJIWVEYVBCJB-CXUHLZMHSA-N 352.419 2.942 50 40 FFGB O=C(CCC(=O)c1cccs1)NNC(=O)CSc1ccccc1F 7652822 JXVOHGAWAUGRAA-UHFFFAOYSA-N 366.439 2.790 50 40 FFGB CCSc1ncc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)cc2)n1 27666246 IYPHCINNJJRLKC-UHFFFAOYSA-N 371.249 2.970 50 40 FFGB Cc1nn(Cc2ccccc2)c(C)c1C(=O)NNC(=O)Cc1ccccc1 7785560 GFNMDEIIXQDVDW-UHFFFAOYSA-N 362.433 2.552 50 40 FFGB COc1cccc2cc(C(=O)N/N=C/c3cccc(OCC(=O)O)c3)oc12 408971889 LMKNUKBEQJUXRE-KEBDBYFISA-N 368.345 2.669 50 40 FFGB Cc1ccccc1-n1c(C)cc(C(=O)NNC(=O)c2cccn2C)c1C 96953471 VEHKXKICXXTQST-UHFFFAOYSA-N 350.422 2.816 50 40 FFGB Cc1ccccc1OCC(=O)N/N=C1\SCC(=O)N1Cc1ccccc1 18143640 LLVFYHJLZLSSHO-VZCXRCSSSA-N 369.446 2.537 50 40 FFGB CCOC(=O)c1ccc(NC(=O)CCl)c(I)c1 2776036 TWIOBNYQXVRWDX-UHFFFAOYSA-N 367.570 2.645 50 40 FFGB O=C1Nc2ccccc2[C@H]1/C=N\NC(=O)C(F)(F)C(F)(F)C(F)(F)F 100303150 KOYVEZNWEZDYTA-FQGROKEMSA-N 371.212 2.657 50 40 FFGB COc1cc(/C=N/NC(=O)COc2c(C)cccc2C)cc(OC)c1OC 1437715 JAZSDYZMNGMLRQ-SRZZPIQSSA-N 372.421 2.858 50 40 FFGB COc1ccc(/C(O)=C/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 100035534 NZPPDONUUXRRQZ-ALAONZSNSA-N 355.350 2.847 50 40 FFGB Cc1cc(OCC(=O)NNC(=O)Cc2cccs2)cc(C)c1Cl 869547 JIAMADKVQIDAGZ-UHFFFAOYSA-N 352.843 2.787 50 40 FFGB O=C(NNS(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1F 7428856 JYKOGUKHHCRBLQ-UHFFFAOYSA-N 363.197 2.756 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)c(C)c1 40128813 PSYLBASAWFWGAX-UHFFFAOYSA-N 374.462 2.560 50 40 FFGB O=C(N/N=C/c1cc(Cl)ccc1O)C(=O)Nc1cccc(Cl)c1 59475505 JWFYEBASBYIQDN-QGMBQPNBSA-N 352.177 2.788 50 40 FFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(C(=O)OC)cc3)ccc21 6226044 AXZKPSIJMJPMPG-CIAFOILYSA-N 364.405 2.915 50 40 FFGB C/C(=N\NC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1cccs1 22918712 ULHGGLMJBCUSBM-HEHNFIMWSA-N 370.522 2.715 50 40 FFGB C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCl 408738633 SWIBMCYWVIHRME-DZGCQCFKSA-N 370.877 2.840 50 40 FFGB COc1ccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)cc1[N+](=O)[O-] 409363992 MTJTUPGMHCPOGG-DJKKODMXSA-N 362.773 2.819 50 40 FFGB CCCc1ccc(OCC(=O)NNC(=O)/C=C/c2ccc(OC)cc2)cc1 1781545 YMISGODDVPUHEE-NTEUORMPSA-N 368.433 2.887 50 40 FFGB O=C(N/N=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1ccccn1 30814091 ANGRPIARTRJXAI-NHDPSOOVSA-N 363.333 2.941 50 40 FFGB COc1cc(OC)cc([C@@H]2C(C#N)=C(N)Oc3cc(N(C)C)ccc32)c1 13586133 FDLHTXDYCJEVSH-IBGZPJMESA-N 351.406 2.988 50 40 FFGB CC(C)(C)NC(=S)NNC(=O)CSc1nc2ccccc2s1 28716618 OKBHCFFBHRACQK-UHFFFAOYSA-N 354.526 2.682 50 40 FFGB CC(C)NC(=C(C#N)C#N)[C@@]1(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)C1(C#N)C#N 78547425 BEFGDEWGNRZEOL-QFBILLFUSA-N 371.360 2.535 50 40 FFGB O[C@@H]1[C@H]2[C@H]3C[C@H]4[C@H]5[C@@H]3[C@H]1[C@@](c1ccccc1)([C@H]5I)[C@@H]24 245264224 CDNDXHOZUAFLPN-LJVLQQGESA-N 364.226 2.860 50 40 FFGB O=C(NNC(=S)NC(=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1 5944667 FPXXTGIWKYJMBV-UHFFFAOYSA-N 368.245 2.943 50 40 FFGB COc1ccc(C(=O)NNC(=O)COc2ccc3ccccc3c2)cc1 829240 HLWOOWWCCBVGRC-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB CCN(CC)C(=O)CSC1=C(C#N)[C@@H](c2ccc(C)cc2)CC(=O)N1 6325198 YDYMITPAHMQRNX-OAHLLOKOSA-N 357.479 2.935 50 40 FFGB COc1cc(/C=N\NC(=O)c2cc3ccccc3o2)cc([N+](=O)[O-])c1O 408848692 SITKJOHXMSBJRF-NVMNQCDNSA-N 355.306 2.819 50 40 FFGB N#C/C(=C\c1ccc(Br)cc1)C(=O)NCCCn1ccnc1 5907798 INWUDECVPCMTHB-GXDHUFHOSA-N 359.227 2.759 50 40 FFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2ccccc2O)CC1 409006870 RLGMQKGGUQYTTO-HYARGMPZSA-N 365.433 2.703 50 40 FFGB C/C(=N\NC(=O)c1cccnc1)c1ccc(I)cc1 7931316 FILDCMRNHYQWRG-LICLKQGHSA-N 365.174 2.840 50 40 FFGB CN1[C@H]2CC[C@@H]1C=C1C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(F)c3)[C@@H]12 102669153 HSQSGIPRWNRTCY-FCLVOEFKSA-N 359.408 2.712 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2ccccc2OC(F)F)cc1 5164361 RBVKRCIRIUSERN-KEBDBYFISA-N 350.321 2.826 50 40 FFGB Cc1cnc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)cn1 7735702 KGIQQPIGRGHSNJ-UHFFFAOYSA-N 374.400 2.511 50 40 FFGB CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3F)[C@H]2C1 35366068 DASOHEDSKCVXGD-WMZOPIPTSA-N 365.387 2.710 50 40 FFGB NNC(=O)c1ccc([C@@H]2c3sc(=O)[nH]c3S[C@@H]3[C@H]4CC[C@@H](C4)[C@H]23)cc1 245241596 KJTWZWQRLVXAGM-QSLWVIQJSA-N 373.503 2.692 50 40 FFGB C[C@H](C(=O)N/N=C/c1c[nH]c2ccccc12)n1cnc2ccccc2c1=O 949528 IMVYDLSZFTZSSH-HJQVIKLGSA-N 359.389 2.589 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2cc3c(cc2Br)OCO3)o1 713161 BYEMDSJUQXATDA-OMCISZLKSA-N 351.156 2.843 50 40 FFGB N#C/C(=C/c1cccnc1)c1nnc(N2CCOCC2)n1-c1ccccc1 33693543 BSFULISCYGYWTC-LGMDPLHJSA-N 358.405 2.563 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc([N+](=O)[O-])c1O 409384283 CLMJRFZRBDYNTR-AUWJEWJLSA-N 370.365 2.795 50 40 FFGB O=C(N/N=C/c1cccnc1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 2419739 WUZJZSVWRMUSCU-ODCIPOBUSA-N 370.718 2.843 50 40 FFGB CC(=O)NN(c1ccccc1)[C@H]1C[C@@H](C)N(c2ccccc2)N1C(C)=O 4131136 HTBSYNVMGJQISS-FOIQADDNSA-N 352.438 2.933 50 40 FFGB Cc1cccc(C)c1-n1c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c1C 4982922 COZLQMLYVSEEHT-FSJBWODESA-N 368.481 2.933 50 40 FFGB O=C(NNC(=O)c1cc(Br)ccc1Cl)c1ccccn1 8197851 JHFIERWNZBQSQO-UHFFFAOYSA-N 354.591 2.572 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2ccc(F)cc2)cc1OC 8812351 NNRJULMZBMSBQU-SRZZPIQSSA-N 374.368 2.540 50 40 FFGB Cn1c(NNC(=O)/C=C/c2ccccc2)nc2sc3c(c2c1=O)CCC3 2261475 ILCXHMXZIXMNSN-ZHACJKMWSA-N 366.446 2.640 50 40 FFGB Cn1cnnc1SCc1ccc(C(=O)N/N=C/c2cccs2)cc1 3244270 GZSNIEHVUINHSL-RQZCQDPDSA-N 357.464 2.933 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)C(=O)Nn1c(C)ccc1C 409380698 BEQRXHCAYFVIHN-AUWJEWJLSA-N 370.365 2.708 50 40 FFGB COc1ccc(Br)cc1/C=C/C(=O)NNC(=O)c1ccco1 8354581 PJBMQZYCYJFWBP-QPJJXVBHSA-N 365.183 2.525 50 40 FFGB CCOC(=O)c1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NC)c2C)cc1 212080103 UYBQHFNBULDAMS-BOPFTXTBSA-N 351.406 2.924 50 40 FFGB COc1ccccc1OCC(=O)NN=C1CCN(Cc2ccccc2)CC1 8182352 ULXWEUKBPVTKEC-UHFFFAOYSA-N 367.449 2.842 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)[C@@H]1[C@H]2CCCC[C@]21C 408722436 IVQJTYNCUVQSMB-JWVDKRPRSA-N 361.398 2.888 50 40 FFGB C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)Cc1cccc(F)c1 10668031 OPCIDJPJVKOSIV-LLVKDONJSA-N 372.425 2.626 50 40 FFGB COc1cccc(/C(C)=N/NC(=O)c2cc(OC)c(OC)c(OC)c2)c1 5785617 QASXBTVDJQESST-UDWIEESQSA-N 358.394 2.875 50 40 FFGB O=C(CN1CCCc2ccccc21)N/N=C1\C(O)=Nc2ccc(F)cc21 8124987 QOMLLHVXELPALM-UHFFFAOYSA-N 352.369 2.700 50 40 FFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc1 408796658 ORGVTPYRSLMBJI-QGOAFFKASA-N 364.401 2.504 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1ccccc1[N+](=O)[O-] 17074193 VEICXOWIKIHEMI-HNNXBMFYSA-N 360.329 2.654 50 40 FFGB Cc1cc(/C=N\NC(=O)c2ccncc2)c(C)n1-c1cccc(C(=O)O)c1 4622075 STGAXVYWWCSPGN-UUYOSTAYSA-N 362.389 2.951 50 40 FFGB C[C@H]1CCc2c(C(=O)NNC(=O)[C@@H]3CCCC[C@@H]3C(=O)O)csc2C1 6469141 CLIRJPAMEQUPHQ-UHTWSYAYSA-N 364.467 2.525 50 40 FFGB CCOc1cccc(/C=N/NC(=O)c2ccc(Br)o2)c1O 993944 XZNATONCVUVGES-LZYBPNLTSA-N 353.172 2.910 50 40 FFGB O=C(N/N=C\c1ccc([N+](=O)[O-])c(O)c1)c1ccc(Br)cc1 36013485 JKRXPLYHGHRQFU-PXNMLYILSA-N 364.155 2.827 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)NNC(=O)c2ccc(F)cc2)c(C)c1 2132092 STHDXMUFZIQILG-UHFFFAOYSA-N 357.385 2.622 50 40 FFGB CC(C)c1ccc(CNC(=O)C(=O)N/N=C/c2ccc(O)c(Cl)c2)cc1 409260546 RVXYUZNLTHOBPS-SSDVNMTOSA-N 373.840 2.936 50 40 FFGB COc1cccc2cc(C(=O)NNC(=S)NCc3ccccc3)oc12 73901364 HPCDUBOMFXYUCS-UHFFFAOYSA-N 355.419 2.751 50 40 FFGB O=C(N/N=C/c1cccc(OCc2ccccc2)c1)C(=O)NC1CCCC1 15225712 OFBIDBXHWNUHFF-HYARGMPZSA-N 365.433 2.775 50 40 FFGB O=C(/C=C/c1ccc(Cl)cc1)NC(=S)NNC(=O)c1cccs1 6243147 FULVMBKPEDXCJS-VMPITWQZSA-N 365.867 2.750 50 40 FFGB COc1ccc(Cl)cc1C(=O)n1c(C)c(C(=O)NN)c2ccccc21 226367099 JSEZOASAOJKDHZ-UHFFFAOYSA-N 357.797 2.904 50 40 FFGB CC(C)(C)c1n[nH]c2c1[C@@]1(C(=O)Nc3ccc(Cl)cc31)C(C#N)=C(N)O2 5095393 JUKAVYPHQWEJRO-SFHVURJKSA-N 369.812 2.685 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2ccc(N3CCCCCC3)nc2)c(C)o1 29754640 PNKCLBVSXJCKMR-UHFFFAOYSA-N 356.426 2.747 50 40 FFGB C/C(N)=C(\C#N)C(=O)CSc1nnc(COc2ccccc2Cl)o1 104398970 GOVSEPMGKUNAPT-KTKRTIGZSA-N 364.814 2.719 50 40 FFGB Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C/c1ccc(N(C)C)cc1 59515646 CXLPHRMRIITVID-RGVLZGJSSA-N 358.829 2.803 50 40 FFGB COc1ccc(OC)c(S(=O)(=O)/N=C(O)/C(C#N)=C\c2ccco2)c1 48493047 SKHWYXVSTQJUAI-FLIBITNWSA-N 362.363 2.549 50 40 FFGB CC(C)(C)NC(=O)c1ccccc1NC(=O)NNC(=O)c1ccccc1 92018439 UVOGUYLBTZFNKM-UHFFFAOYSA-N 354.410 2.681 50 40 FFGB Cc1ccn2cc(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)nc2c1 15762292 SYXALWLSVFXXBP-LLVKDONJSA-N 368.462 2.904 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc1 409183355 RUUWSVWMTBWBNN-CIAFOILYSA-N 354.406 2.548 50 40 FFGB N#CC1=C(N)Oc2c(ccc3c(O)cccc23)[C@]12C(=O)Nc1ccccc12 36649121 RZYAFEKQNIAQGL-NRFANRHFSA-N 355.353 2.870 50 40 FFGB O=C(N/N=C/c1cccc(Br)c1)c1cc([N+](=O)[O-])ccc1O 409160903 KFADTYRKBMNFBU-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB NC(=O)N/N=C1\c2ccccc2-c2ccc(I)cc21 100847850 HAOMTFOHQBBDSR-GHRIWEEISA-N 363.158 2.692 50 40 FFGB Cc1cc(C(=O)NNS(=O)(=O)c2ccccc2)c(C)n1-c1ccccc1 7409359 YAWWBRKZZPVOFG-UHFFFAOYSA-N 369.446 2.717 50 40 FFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1c[nH]c2ccccc12 2739076 VKSMXUITZHEBFF-FBCYGCLPSA-N 352.306 2.569 50 40 FFGB O=S(=O)(c1ccc(Br)cc1)N(CCCl)CCCl 1688254 VEGIYGNEKMIXCW-UHFFFAOYSA-N 361.088 2.917 50 40 FFGB Cn1cccc1C(=O)NN[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1 40007534 AQKVJWZZJAKMCK-SFHVURJKSA-N 366.396 2.779 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC 6581066 NZIWHXKVVATKDY-XDHOZWIPSA-N 355.350 2.932 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1cc(Br)c(O)c(Br)c1 59333457 PGPGSUYTMJMDIE-BAQGIRSFSA-N 374.032 2.912 50 40 FFGB COc1ccc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1O 5030908 WJSYLLMMKWZXJD-GIJQJNRQSA-N 356.407 2.520 50 40 FFGB N#C/C(=C\c1ccccc1OCC(N)=O)C(=O)Nc1ccc(Cl)cc1 4682248 OZFCXOUZOMQXBP-UKTHLTGXSA-N 355.781 2.750 50 40 FFGB COc1cc(C)c(/C=N\NC(=O)COc2ccccc2OC)cc1OC 408548817 LQCMUEWAPVINSO-JAIQZWGSSA-N 358.394 2.550 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc(Cl)cc3)CC2=O)cc1 1421511 UVCTUJUQMPLIHN-FVUPAENESA-N 371.824 2.852 50 40 FFGB O=C(NNC(=O)c1ccccc1-c1ccccc1C(=O)O)c1ccco1 807001 AJSFMEHBNBHIAP-UHFFFAOYSA-N 350.330 2.720 50 40 FFGB CCOc1ccccc1NC(=O)NNC(=O)COc1ccc(CC)cc1 2532735 MTQLPWRPNSPXPI-UHFFFAOYSA-N 357.410 2.879 50 40 FFGB O=C1N/C(=N\NC(=O)c2ccccc2O)S/C1=C\c1ccc(Cl)cc1 6606256 CGHCLKQOJSEQLG-ZROIWOOFSA-N 373.821 2.951 50 40 FFGB C/C(=N\NC(=O)CCN1CCN(c2ccccc2)CC1)c1cccs1 20756607 KDKXMAFRAMMFQE-CAPFRKAQSA-N 356.495 2.801 50 40 FFGB Cc1ncsc1C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C 58996128 LXTMAONEKJCIOP-UHFFFAOYSA-N 354.435 2.934 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(Cl)cn2)cc1 18093791 ZTZGLXJRJVDBST-SRZZPIQSSA-N 360.801 2.878 50 40 FFGB C/C(=N\NC(=O)c1ccncc1)c1cccc(NC(=O)C(F)(F)F)c1 17072658 PONRMKKJFYMHEM-LSHDLFTRSA-N 350.300 2.736 50 40 FFGB O=C(NNc1ccccc1[N+](=O)[O-])c1cccc(OC[C@@H]2CCCO2)c1 32903012 CCTKWIXCPMNINC-HNNXBMFYSA-N 357.366 2.910 50 40 FFGB O=C(N/N=C/c1cccc(O)c1)c1ccccc1I 1058685 OPPSUBVFLKRWRA-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB COc1ccc(C(=O)COC(=O)CCCCBr)cc1OC 72333707 VOLSATADEBDLBM-UHFFFAOYSA-N 359.216 2.995 50 40 FFGB CC(C)[C@]12N=C(O)[C@](C#N)(C(C#N)=C(I)N1)C2(C)C 66088013 DFCFPXHEGWFHHM-QWHCGFSZSA-N 370.194 2.618 50 40 FFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12369343 ZLLDMIKHPWSQLQ-JAIQZWGSSA-N 365.349 2.757 50 40 FFGB C=CCn1c(O)c(C(=O)N/N=C/c2ccccc2F)c(=O)c2ccccc21 5668271 NQHXILKFERFVCI-WSDLNYQXSA-N 365.364 2.796 50 40 FFGB Cn1c(=O)c(NC(=O)CCl)c2c3c(cccc31)C(=O)c1ccccc1-2 15106421 KVLLNFRXWVZCIS-UHFFFAOYSA-N 352.777 2.927 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N\NC(=O)Cc1cc(C)ccc1C 409365728 RQYXHWFFLGAUKC-JAIQZWGSSA-N 371.393 2.922 50 40 FFGB CCOc1ccc([C@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1OC 409123951 GDDPVDUSMKNOCJ-SFHVURJKSA-N 353.422 2.824 50 40 FFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1cccc(Br)c1 409180440 SSSHDLHJRCNHTJ-GIJQJNRQSA-N 361.195 2.871 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccccc2)cc(Cl)c1OCC(=O)O 409359479 OLKZSEFVFINNBM-DJKKODMXSA-N 362.769 2.576 50 40 FFGB O=C(NCc1ccccc1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1 32826188 KLCBTFOPYCASAQ-UHFFFAOYSA-N 373.356 2.806 50 40 FFGB Cc1cccc(/C=N/NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)c1 19955495 DUQRZSFPKVCUAG-UDWIEESQSA-N 373.478 2.528 50 40 FFGB O=C(COC(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1 3512161 RQDYJFMBLXNBMU-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccc(N(C)C)cc1 8733444 XRSPVDURFZAEQB-AWEZNQCLSA-N 370.291 2.761 50 40 FFGB C#CCOc1c(/C=C(\C#N)C(=O)NCC)cc(Br)cc1OC 408819791 TWVCRODSCVYDRT-KPKJPENVSA-N 363.211 2.513 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)c2c(C)nc3ccccn23)c(O)c1 9335414 WQNZXFDUDURIRJ-FYJGNVAPSA-N 365.437 2.958 50 40 FFGB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@H]1C[C@@H]1c1ccccc1 4729468 XQCBUEOBLUJVME-MXDRFRHJSA-N 351.362 2.559 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@@H]2C[C@H]2c2cccc(F)c2)c2ccccc21 67132457 ZNLWSDYZZCJIND-JKSUJKDBSA-N 351.381 2.882 50 40 FFGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C1=NN(c2ccccc2)[C@@H](N)[C@@H]1C#N 408903941 BMGUAXWNAZIKKJ-NGUOXWILSA-N 374.360 2.508 50 40 FFGB N#C/C(=C\c1cccc(OCC(=O)O)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 408922776 GMVHCDDZKGFZGH-NTUHNPAUSA-N 367.317 2.604 50 40 FFGB CCS(=O)(=O)[C@@H](I)C(=O)c1ccc(Cl)cc1 96517954 CKBMAEJESTXBIL-SNVBAGLBSA-N 372.611 2.719 50 40 FFGB CC(=O)[C@@H]1N(S(=O)(=O)c2ccc(C)cc2)C([C@H](C)Cl)=NC1(C)C 24718459 VLPKNRYRNYLHDY-FZMZJTMJSA-N 356.875 2.761 50 40 FFGB biogenic O=C(NNC(=O)c1ccc2ncsc2c1)c1ccc2ncsc2c1 40158844 LSGOEMUTMLNFMB-UHFFFAOYSA-N 354.416 2.981 50 40 FFGB O=C(N/N=C/c1ccccc1O)c1ccc(I)cc1 10476070 HFWXCAISLBILFF-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB O=C(N/N=C/c1ccccc1C(=O)O)C(=O)Nc1cccc2ccccc12 59444445 IQMSVENXVYQBRT-CIAFOILYSA-N 361.357 2.627 50 40 FFGB C[C@@H](SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1)C(=O)Nc1ccccc1F 9683004 ICPACHAKFFHWHW-MNOVXSKESA-N 372.425 2.917 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc(Cl)c(O)c(OC)c2)c(O)c1 409391439 JJNYTDDJRMOBDQ-QGMBQPNBSA-N 350.758 2.532 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc(OC)cc2)ccc1OC(C)=O 408752438 AOLPYBFHIZFALI-UDWIEESQSA-N 356.378 2.783 50 40 FFGB COc1ccccc1[C@@H]1[C@@H](C(=O)C2CC2)N2C=C(C#N)C=C[C@@H]2C1(C#N)C#N 4729606 VTGZRMNOOGIDGF-AQNXPRMDSA-N 370.412 2.822 50 40 FFGB O=C(N/N=C/c1cccc(O)c1)C1CCN(C(=O)c2ccc(F)cc2)CC1 409004352 BZRAAYCLYZZLFN-LPYMAVHISA-N 369.396 2.534 50 40 FFGB CCOc1cc2c(cc1/C=N/NC(=O)Cc1cccc(OC)c1)OCO2 409092029 XCCYIBLCUAFJCV-RGVLZGJSSA-N 356.378 2.515 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1cc2c(cc1Cl)OCO2 408724795 CHDHTTRIIOVYAM-QGMBQPNBSA-N 361.741 2.670 50 40 FFGB Cc1ccc(NCC(=O)N/N=C/c2ccc(N3CCOCC3)cc2)cc1C 409104785 IEPOJFFQHKAKGA-OEAKJJBVSA-N 366.465 2.702 50 40 FFGB COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)ccc1O 832744 FQDMKTHUGMFLEI-INIZCTEOSA-N 362.341 2.725 50 40 FFGB biogenic Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c2C)cc1C 58903906 ZULSODOMMFLMQS-FSJBWODESA-N 368.481 2.933 50 40 FFGB Cc1ccc(C(=O)N/N=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 409008480 WWAWFYOAIKPILM-MOSHPQCFSA-N 368.393 2.504 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)c2oc3ccccc3c2C)c(C)c1 7380383 WXUNAMDHMGHACO-UHFFFAOYSA-N 358.419 2.981 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)Cc1cc(C)ccc1C 409366317 UGTJMSAQDVBGQT-BKUYFWCQSA-N 365.389 2.916 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccccc1Cl 408609361 ZUDPTKMMRUEBCH-ZDUSSCGKSA-N 360.826 2.898 50 40 FFGB O=C(CNC(=O)c1ccc(Cl)cc1)N/N=C\c1c[nH]c2ccccc12 36077401 WROAWGIHOJHIFJ-YVNNLAQVSA-N 354.797 2.701 50 40 FFGB CC(C)c1ccc(/C=N/NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 409134474 TXBVDNXIVQKVGC-DEDYPNTBSA-N 373.478 2.970 50 40 FFGB COc1ccc(-c2cc(C(=O)NNc3ncnc4ccccc34)n[nH]2)cc1 1775971710 ZJJGYEDYMDBUST-UHFFFAOYSA-N 360.377 2.785 50 40 FFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)C1CCCCC1 12488591 DRAIZRHNHUOBIH-UHFFFAOYSA-N 369.259 2.864 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1ccccc1Br 5583591 GKHJTDPKXDLUJT-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CNC1=C/C(=N/C2=C/C(=N\C(=C/C#N)C(C)(C)O)OC2(C)C)OC1(C)C 6003932 UEVOZOYNOPOHNZ-FNJNDHMQSA-N 358.442 2.567 50 40 FFGB COc1ccc(NC(=S)NNC(=O)CCc2ccccc2)c(OC)c1 6397927 SUORRHJWGGSWJY-UHFFFAOYSA-N 359.451 2.654 50 40 FFGB COc1cc(Br)c(O)c(/C=N/NC(=O)Cc2ccccc2)c1 408587931 HTOIFTSFTFRTKZ-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB O=C(CC(=O)N/N=C\c1cccc(Br)c1)NCc1ccccc1 408752120 FVGSZKLYPIXUAL-NDENLUEZSA-N 374.238 2.606 50 40 FFGB CCCc1n[nH]c2c1[C@@H](c1cc3c(cc1Cl)OCO3)C(C#N)=C(N)O2 32509943 ORFURBLKFICVRL-AWEZNQCLSA-N 358.785 2.962 50 40 FFGB COc1cc(/C=N/NC(=O)CNc2cccc(C)c2)cc(OC)c1OC 1444780 PFULLCPDNZNVFW-SRZZPIQSSA-N 357.410 2.583 50 40 FFGB CCOC(=O)COc1cc(/C=N\NC(=O)Nc2ccccc2)ccc1OC 409209221 GYMSJJVSWICEAQ-NDENLUEZSA-N 371.393 2.793 50 40 FFGB Cn1cc(/C=N/NC(=O)CN2C[C@@H](c3ccccc3)CC2=O)c2ccccc21 408977596 XLIJCHODQMDSNE-FZJZADEZSA-N 374.444 2.645 50 40 FFGB N#C/C(=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)C(=O)NC(N)=O 409249052 JCLYVFHTECVKPB-YVMONPNESA-N 360.713 2.610 50 40 FFGB Cc1ccc(C(=O)N/N=C\c2cc3c(cc2Br)OCO3)cn1 30802983 GKZMPFSDOZCMCV-WSVATBPTSA-N 362.183 2.645 50 40 FFGB Cc1cc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc(C)c1Cl 903805 FJLUYOXUHHWCRI-REZTVBANSA-N 351.746 2.987 50 40 FFGB CCCCCC(=O)NNC(=O)c1nn(CCCCC)c(=O)c2ccccc12 12773795 MSYAHNFKJXPJPR-UHFFFAOYSA-N 372.469 2.928 50 40 FFGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)N1CCN(c2ccccc2)CC1 15227178 NCZCTPQIMWTVLN-ATVHPVEESA-N 361.401 2.671 50 40 FFGB COC(=O)c1ccccc1N/C=C(\C#N)C(=O)NCc1ccc(OC)cc1 8995459 UHIFLGHDCGHWII-FYWRMAATSA-N 365.389 2.618 50 40 FFGB Cn1cccc1CC(=O)NNC(=S)Nc1ccc(Cl)cc1Cl 8692034 FPVBGMRDDZLHFB-UHFFFAOYSA-N 357.266 2.892 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1sc(NC(=O)C(C)(C)C)cc1C 104825699 ZXJHDIAAFBZVBW-KHPPLWFESA-N 363.439 2.523 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)C23CC4C[C@@H](CC[C@H](C4)C2)C3)cc1 100809996 OLWHVTKPNBOHAP-JYMZVQIXSA-N 362.495 2.911 50 40 FFGB NNC(=O)c1ccccc1OCC(=O)Nc1ccc(SC(F)F)cc1 3259194 NYEQTYQGDIGAMI-UHFFFAOYSA-N 367.377 2.622 50 40 FFGB O=C(CCC(=O)Nc1cccc(Br)c1)N/N=C/c1ccco1 2166416 BZCXMDHJXIVSAP-LICLKQGHSA-N 364.199 2.911 50 40 FFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@]21C(=O)Nc2ccc(Cl)cc21 4142267 XWAVXXGMXXFKDC-LJQANCHMSA-N 369.808 2.897 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])NNC(=O)CC12CC3CC(CC(C3)C1)C2 5787264 MCMOMRBJJLSQAZ-UHFFFAOYSA-N 371.437 2.891 50 40 FFGB O=C(N/N=C\c1ccccc1I)c1cccc(O)c1 408552019 RIERFTXANZJKJE-SXGWCWSVSA-N 366.158 2.761 50 40 FFGB C[C@H](Br)C(=O)NC[C@H](O[C@@H]1CCOC1)c1cccc(F)c1 95097930 VHPHYPYBRHIIEX-GDLCADMTSA-N 360.223 2.572 50 40 FFGB CCOc1ccc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC 3098366 QQRBJODUDJCNKG-XDHOZWIPSA-N 357.366 2.695 50 40 FFGB CC(C)CC(=O)NNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 12757820 PDAIJABWWOFKQF-UHFFFAOYSA-N 358.769 2.714 50 40 FFGB N#C/C(=C\c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1)C(N)=O 408764531 UMJOHMVSDXIGHH-MDWZMJQESA-N 355.781 2.750 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccc(Cl)cc1 408612730 YNSPVGCOKKBQJF-WSDLNYQXSA-N 371.824 2.671 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)CSCCc2ccccc2)cc1 15227412 IMJOFMKHXJKNGH-DEDYPNTBSA-N 356.447 2.899 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)C1CCCCC1 100613987 HMJVIPBGXPUIGQ-FYJGNVAPSA-N 359.426 2.859 50 40 FFGB COc1cc(/C=C/C(=O)NNc2oc(C(C)C)nc2C#N)cc(OC)c1 58032085 RNDNDYQJKFVEOV-AATRIKPKSA-N 356.382 2.843 50 40 FFGB C/C(=N\NC(=O)Cc1c[nH]c2ccccc12)c1ccc(-n2cncn2)cc1 20818150 GJFDIKHQNMXCPU-ZVHZXABRSA-N 358.405 2.832 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(C)cc1 408606257 PKUCOYXVZHLWDD-OAHLLOKOSA-N 354.435 2.943 50 40 FFGB COc1cc(OC)c(OC)cc1/C=N\NC(=O)c1cn(C)c2ccccc12 33333656 PIBCVWFZPYGSIA-NHDPSOOVSA-N 367.405 2.968 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c(OC)c1OC 6230248 BASILDYGFCJUJB-RAXLEYEMSA-N 354.362 2.964 50 40 FFGB N#CC1=C(SCC(N)=O)NC2=C(C(=O)CCC2)[C@H]1c1ccccc1Cl 1087726 CMHGPHDDHSLWFX-INIZCTEOSA-N 373.865 2.988 50 40 FFGB Cn1cc(Br)c(C(=O)Oc2cccc(C=C(C#N)C#N)c2)n1 1061848 CYEANCUQFKIJKT-UHFFFAOYSA-N 357.167 2.832 50 40 FFGB COc1ccccc1OCCCOc1c(/C=N/NC(N)=O)cccc1OC 41108626 MAMCLWWOIVYNBC-FYJGNVAPSA-N 373.409 2.554 50 40 FFGB NC(=O)N/N=C1/c2ccccc2-c2ccc(I)cc21 13564598 HAOMTFOHQBBDSR-LGMDPLHJSA-N 363.158 2.692 50 40 FFGB CC(=O)O[C@@H]1C[C@@H]2[C@H](Br)[C@@H]1NC2(C(F)(F)F)C(F)(F)F 100040614 RMADYUJTAOPBEY-MVIOUDGNSA-N 370.087 2.537 50 40 FFGB N#CC1=C(N)Oc2oc3ccccc3c(=O)c2[C@H]1c1ccc2c(c1)OCCO2 1070312 UCDLGUVOEHUQTF-KRWDZBQOSA-N 374.352 2.782 50 40 FFGB Cc1ccc(N2C(=O)C[C@H](NNC(=O)c3cccc(Cl)c3)C2=O)cc1C 100097032 OVHZTSBFRVQGOJ-INIZCTEOSA-N 371.824 2.523 50 40 FFGB Cc1cc(C(=O)N/N=C/c2cccc(OC(=O)/C=C/c3ccco3)c2)[nH]n1 4112922 KDEKRCHCMIGAGN-BYHMIWLJSA-N 364.361 2.694 50 40 FFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\c1ccc(-c2cccc(C(=O)O)c2)o1 13660188 WMFDNWQHCAKPKB-DHDCSXOGSA-N 362.341 2.867 50 40 FFGB N#Cc1ccc(/C=N\NC(=O)c2ccc(Cn3cc(Cl)cn3)o2)cc1 32705939 NNPSZWFMGIFLNN-ZBKNUEDVSA-N 353.769 2.813 50 40 FFGB O=C(CCl)N(c1ccc(Cl)c(Cl)c1)[C@H]1CCS(=O)(=O)C1 40177607 ODJWKANAUXJKEP-VIFPVBQESA-N 356.658 2.752 50 40 FFGB O=C(NN1C(=O)[C@H](Cl)[C@H]1c1cccc(Cl)c1)c1ccccc1O 1633517 GVALIQHSELKKKI-ZIAGYGMSSA-N 351.189 2.881 50 40 FFGB Cc1ccccc1-n1ncc(C(=O)NNC(=O)c2cccnc2)c1C1CC1 29749775 QXAXLVOPMOHANH-UHFFFAOYSA-N 361.405 2.528 50 40 FFGB C[C@@H](Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1ccc(O)cc1O 673205 YLEJRFUCYXQELE-SVXRXWARSA-N 356.407 2.605 50 40 FFGB Cc1cccc(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)c1C 8474883 VEPIMNVKKALHAX-YQBXUVTMSA-N 364.239 2.813 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cccnc1SC 5885498 XTHYZCXEBXPLHL-UHFFFAOYSA-N 351.815 2.540 50 40 FFGB C/C(=N\NC(=O)COc1ccccc1C#N)c1ccc(-n2ccnc2)cc1 8045719 OGKZRVBKQMQIOS-HZHRSRAPSA-N 359.389 2.663 50 40 FFGB O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc(Br)cc1 2621663 YYDRUWRQLFXKMP-UHFFFAOYSA-N 372.222 2.934 50 40 FFGB CC[C@H](Nc1ccc(OC)cc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 695820 MVOPEQVVNOOQFL-DAQNXSASSA-N 356.382 2.944 50 40 FFGB O=C(N/N=C/c1cccc(Br)c1)[C@@H]1COc2ccccc2O1 783311 GTJAWIIQCKTBFQ-UPAIAECRSA-N 361.195 2.739 50 40 FFGB C/C(N)=C(\C#N)C(=O)CSc1nnc(COc2cc(C)ccc2C)o1 104869686 JLDXOGMCIGFDSE-SEYXRHQNSA-N 358.423 2.683 50 40 FFGB CCc1ccc(N(CC(=O)N/N=C(\C)C(C)(C)C)S(C)(=O)=O)cc1 409023663 AZKXGCLNLDRAKY-QGOAFFKASA-N 353.488 2.553 50 40 FFGB N#CC1=C(SCC(N)=O)NC(=O)C[C@@H]1c1cccc(Cl)c1Cl 2312043 QYMBSYGVNBUBLZ-MRVPVSSYSA-N 356.234 2.551 50 40 FFGB CCOc1cc(/C=C/C(=O)NNC(=O)c2ccco2)ccc1OC(F)F 8354758 AQXMMLIKMQWCOW-SOFGYWHQSA-N 366.320 2.754 50 40 FFGB COc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1O 408961881 PEJHKMHNUQVLTL-GIJQJNRQSA-N 355.306 2.819 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1ccc(O)cc1O)CO2 30742903 RFVKPPWNEHMWOF-OIQMFWTRSA-N 370.405 2.685 50 40 FFGB O=C(N/N=C/c1cccnc1)C(=O)Nc1ccc(Oc2ccccc2)cc1 4499479 BAUCQEXZSHHPBB-HYARGMPZSA-N 360.373 2.963 50 40 FFGB CC(C)(C)[Si](C)(C)OC[C@@H]1CC[C@@H](n2cnc3c(=O)[nH]cnc32)O1 195506176 UBDRNBJBRQIQCA-RYUDHWBXSA-N 350.495 2.819 50 40 FFGB NC(=O)COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)cc1 15147359 PMTDPTVKWYFMKI-DNTJNYDQSA-N 366.204 2.621 50 40 FFGB COc1ccc(/C=N/NC(=O)C(C)(C)O)cc1OCc1cccc(F)c1 32578394 GJFLHOYZBVBXGL-SRZZPIQSSA-N 360.385 2.634 50 40 FFGB CCOc1ccccc1N1C[C@@H](C(=O)Oc2ccc([N+](=O)[O-])cc2)CC1=O 7929362 JRGKIDCPIJHNQL-ZDUSSCGKSA-N 370.361 2.952 50 40 FFGB CS(=O)(=O)c1cccc(C(=O)NNc2ccccc2C(F)(F)F)c1 32999883 TYZUSRMEVXIHRW-UHFFFAOYSA-N 358.341 2.866 50 40 FFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)n(C)c2ccccc32)cc1 20086067 MFFUVSXDMCALTO-KRWDZBQOSA-N 359.385 2.765 50 40 FFGB O=C(N/N=C/c1ccccc1Cl)c1nc(O)c2cc([N+](=O)[O-])ccc2n1 18024629 BVNWERPMTOPLND-QGMBQPNBSA-N 371.740 2.661 50 40 FFGB COC(=O)N/N=C/c1ccc(OCCOc2cccc(OC)c2)c(OC)c1 4525997 YXYZGLBKEFXECM-DEDYPNTBSA-N 374.393 2.852 50 40 FFGB N#C/C(=C/c1ccc(N2CCOCC2)o1)C(=O)NCCCc1ccccc1 409250239 MTGRTJBQMNEWNG-SDXDJHTJSA-N 365.433 2.772 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccccc1Cl 408609358 ZUDPTKMMRUEBCH-CYBMUJFWSA-N 360.826 2.898 50 40 FFGB O=C(N/N=C\c1ccc(SCCO)c([N+](=O)[O-])c1)Nc1ccccc1 32124737 GPFPHZRENAIAJN-BOPFTXTBSA-N 360.395 2.835 50 40 FFGB O=C(CSc1nnnn1-c1ccccc1)N/N=C\c1ccc(Cl)cc1 32703136 IEDRDWGWRAOBHA-ZDLGFXPLSA-N 372.841 2.558 50 40 FFGB CCCCCCCCC(=O)NNC(=O)c1c(O)n(C)c2ccccc2c1=O 136311444 ISICMESCOGQYSO-UHFFFAOYSA-N 373.453 2.756 50 40 FFGB CCOC(=O)NNC(=O)c1cc(Br)c(Br)s1 36310117 PXGCEWKUBKBKJE-UHFFFAOYSA-N 372.038 2.664 50 40 FFGB CC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(-n3cncn3)cc2)cc1 12898822 UJVKJBKIBZUEEJ-UHFFFAOYSA-N 363.421 2.640 50 40 FFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(-n2cccn2)cc1 17158338 XTWVOAWGPYJUBH-UHFFFAOYSA-N 364.449 2.850 50 40 FFGB CCN(CC)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cn1 65530549 FXEFUUBBRKWPKO-UHFFFAOYSA-N 370.497 2.905 50 40 FFGB Cc1ncc[nH]/c1=N\N=C\c1ccc(N(CCCl)CCCl)cc1 1704178 BZUKWQAECDBYJZ-CIAFOILYSA-N 352.269 2.937 50 40 FFGB C/C(=N/NC(=O)CCC(=O)Nc1cc(C)ccc1C)c1ccc(O)cc1O 12447246 IQKUTJGWFRLNRF-HMAPJEAMSA-N 369.421 2.974 50 40 FFGB Cc1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)C(=O)O)[C@H](Cl)C(=O)O2 4974356 ADWQHMXRYKUWAT-XIRDDKMYSA-N 359.809 2.848 50 40 FFGB CCN(NC(=O)CN1C(=O)[C@H](C)Oc2ccccc21)c1ccc(C)cc1 26075287 PZBJZYQGMCVMGD-HNNXBMFYSA-N 353.422 2.667 50 40 FFGB COc1ccc(SCC(=O)N/N=C\c2cc([N+](=O)[O-])ccc2O)cc1 409106505 MJHAJBRCEOUVAR-MFOYZWKCSA-N 361.379 2.551 50 40 FFGB CCOc1ccc2oc(C(=O)NNC(=O)c3ccccc3O)c(C)c2c1 12932780 NDCJTNOPIXBSTP-UHFFFAOYSA-N 354.362 2.920 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccccc2O)c(Br)cc1O 2774436 FDMBBCAOOXGRHX-CAOOACKPSA-N 365.183 2.633 50 40 FFGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)Cn1cnc2ccccc21 6831013 ROCXFURJZPVFGJ-FSJBWODESA-N 372.432 2.989 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2cccc3cccnc23)c(OC)c1 59503461 UWFKGIBLGFZGRU-WSDLNYQXSA-N 365.389 2.781 50 40 FFGB Cc1[nH]c(C(=O)NNc2ccccc2[N+](=O)[O-])c(C)c1C(=O)OC(C)C 9450773 IKQHEWLHSCZFEM-UHFFFAOYSA-N 360.370 2.862 50 40 FFGB O=C(NNS(=O)(=O)c1ccccc1)c1cc2c(s1)CCCCC2 12857596 QEKQLZFRKFGXBM-UHFFFAOYSA-N 350.465 2.640 50 40 FFGB O=C(NNC(=O)C1CCN(c2nc3ccccc3o2)CC1)c1cccs1 14227090 JNMHIJSLBQBNTR-UHFFFAOYSA-N 370.434 2.567 50 40 FFGB O=C(N/N=C/c1cc(Cl)ccc1O)C(=O)Nc1ccccc1Cl 409168560 MPFUWTXYEWNYPK-QGMBQPNBSA-N 352.177 2.788 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1ccc(N(C)C)c(Br)c1 408804992 IDMFJHDSSHERBN-UKTHLTGXSA-N 366.259 2.575 50 40 FFGB COC(=O)c1ccc(COc2ccc(/C=N/NC(=O)C3CC3)cc2)cc1 3245754 SHKGJAIBJVRUEL-CIAFOILYSA-N 352.390 2.912 50 40 FFGB CC(C)c1ccc(/C=C/C(=O)NC(=S)NNC(=O)c2ccncc2)cc1 6358932 YTPXICBQTQBYEF-VMPITWQZSA-N 368.462 2.554 50 40 FFGB CNC1=C/C(=N\C2=C/C(=N\C(=C/C#N)C(C)(C)O)OC2(C)C)OC1(C)C 104311070 UEVOZOYNOPOHNZ-HUBOHXDGSA-N 358.442 2.567 50 40 FFGB O=C(NCc1ccccc1)NNc1nc2sc3c(c2c(=O)[nH]1)CCCC3 1263391 SCOFQSQAEBSCBH-UHFFFAOYSA-N 369.450 2.690 50 40 FFGB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1O 5172078 PACQUCIPRCUJHY-SNVBAGLBSA-N 350.827 2.987 50 40 FFGB C/C(=C\C(=O)C(F)(F)C(F)(F)F)NNC(=O)COc1ccccc1C 408954911 NQVTZSGCQRMCCC-JXMROGBWSA-N 366.286 2.665 50 40 FFGB Cc1nc2ccc(Br)cn2c1C(=O)N/N=C/c1cccnc1 409011567 GWLMHKGMTRMTAN-QGMBQPNBSA-N 358.199 2.564 50 40 FFGB CN(C)c1ccc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1 33333807 YMRVCNABEMOLHT-ODLFYWEKSA-N 353.451 2.871 50 40 FFGB CC1=C(/C=C/C(C)=N/NC(=O)N[C@H]2CCS(=O)(=O)C2)C(C)(C)CCC1 585145918 DCCXEIGOHAGHAK-ORNFAYKGSA-N 367.515 2.931 50 40 FFGB Cn1cc(Br)c(C(=O)N/N=C/c2c(O)ccc3ccccc23)n1 1082128 WPALNIPGTMBJHD-QGMBQPNBSA-N 373.210 2.805 50 40 FFGB Cc1ccc(Sc2ccc(/C=N/NC(=O)Cc3nnc(N)s3)o2)cc1 2273854 UKWSEIIHKDJHIY-GIJQJNRQSA-N 373.463 2.866 50 40 FFGB CO[C@H](C(=O)NNC(=O)COc1ccc(Cl)cc1C)c1ccccc1 5724971 GXNGPOVXYYDHGK-KRWDZBQOSA-N 362.813 2.562 50 40 FFGB Cc1cc(C)nc(NNC(=O)C2CCN(c3nc4ccccc4o3)CC2)n1 13017133 VROXMRWZTVMYJE-UHFFFAOYSA-N 366.425 2.594 50 40 FFGB O=C(Cc1ccc2ccccc2c1)NNC(=O)c1cnc2ccccc2n1 53605331 NUNJTCBFDUALLY-UHFFFAOYSA-N 356.385 2.787 50 40 FFGB N#CC1=C(S)NC(c2cccnc2)=C(C(N)=S)[C@@H]1c1ccncc1 2361679 UDPZGQPMDCRYTO-CYBMUJFWSA-N 351.460 2.526 50 40 FFGB Cc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccco3)cc2)cc1 408840009 ADIRRXITMFQBHK-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB CCn1nc(C(F)(F)F)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2 253399302 IWDMUWDXFGXQQD-CYBMUJFWSA-N 352.316 2.737 50 40 FFGB Cc1nn(CC(F)F)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253394148 ALOVFOQYWPVUEZ-HNNXBMFYSA-N 362.380 2.908 50 40 FFGB CSc1ncc(/C=N/NC(=O)c2cccc(Br)c2)cn1 13957172 DKVCFCVHYFXOFQ-CAOOACKPSA-N 351.229 2.725 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1[N+](=O)[O-] 1431177 XSJNITRKYUDLBZ-VXLYETTFSA-N 357.366 2.749 50 40 FFGB N[C@@H](CSSC[C@H](N)C(=O)c1ccccc1)C(=O)c1ccccc1 1577759 ZDBVPJBBFXZIQV-HOTGVXAUSA-N 360.504 2.788 50 40 FFGB O=C(NNc1ccc(F)cc1)C1CCN(C(=O)c2ccc(F)cc2)CC1 45970711 UQUBSRZPERXDQC-UHFFFAOYSA-N 359.376 2.960 50 40 FFGB Cc1ccc(NC(=O)[C@@H](NNC(=O)c2cccn2C)c2ccccc2)cc1 32814709 RMIUQFRRPCSZDF-IBGZPJMESA-N 362.433 2.948 50 40 FFGB Cc1cc(N(CCCl)CCCl)ccc1/C=N\C(C#N)=C(/N)C#N 104228757 ZHANMIIOHWTZAR-UMNGZHQCSA-N 350.253 2.915 50 40 FFGB COc1ccccc1OCC(=O)N/N=C(\C)c1ccc(NC(C)=O)cc1 408862493 KKIXYQSILTUSDV-FYJGNVAPSA-N 355.394 2.573 50 40 FFGB COc1cc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)ccc1O 3577078 PTGGTEAYXMHSBF-LSFURLLWSA-N 367.327 2.982 50 40 FFGB COc1ccc(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)cc1 832003 GTCVWIIWYZYMAK-UHFFFAOYSA-N 369.204 2.842 50 40 FFGB CCn1c(SCC(=O)NNC(=O)c2cccs2)nc2ccccc21 6508493 UIXZBOOTOVDZBH-UHFFFAOYSA-N 360.464 2.671 50 40 FFGB O=C(CC(=O)N/N=C/c1ccc(Cl)cc1Cl)NCc1cccnc1 59461576 FUFSOKXDZALCHN-UFFVCSGVSA-N 365.220 2.545 50 40 FFGB COc1ccc(CCNC(=O)C/C(C)=N/NC(=O)Cc2cccs2)cc1 100892226 FKEMGTRVTOLFFO-KGENOOAVSA-N 373.478 2.540 50 40 FFGB COc1ccc2c(c1)c(C(=O)N/N=C/c1ccc(O)c(O)c1)c(C)n2C 2231823 GRSYYSJWKKXZNH-KEBDBYFISA-N 353.378 2.670 50 40 FFGB N#C/C(=C\c1ccc(-c2ccccc2C(=O)O)o1)C(=O)NC[C@@H]1CCCO1 408734893 LFLLQCUVRZOQBP-VOMSXAGXSA-N 366.373 2.847 50 40 FFGB CCn1c(SCC(=O)N/N=C/c2cccn2C)nnc1-c1ccccc1 863970 GDEDSAASPCTRFS-XDHOZWIPSA-N 368.466 2.546 50 40 FFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccccc3OC)CC2=O)cc1 15913772 YZUANCFZBKFKFE-RIWZNOJBSA-N 365.433 2.761 50 40 FFGB C/C(CC(=O)NCc1ccc(F)cc1)=N\NC(=O)c1cccc(C)c1O 4904559 NYXYTHCPFVCIKP-LPYMAVHISA-N 357.385 2.652 50 40 FFGB CN1CCN([P@](=O)(c2ccccc2)c2nc3ccccc3s2)CC1 8015322 PTKNZVBICBYBJY-QHCPKHFHSA-N 357.419 2.773 50 40 FFGB COCc1noc2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)N2 101965352 NERBYBQRIPUOHI-LBPRGKRZSA-N 361.199 2.835 50 40 FFGB O=C(NCc1ccc(F)cc1)C(=O)NNc1ccc(Cl)cc1Cl 57996206 RLWICHXGHMXAPP-UHFFFAOYSA-N 356.184 2.892 50 40 FFGB CNC(=O)/C(C#N)=C/c1c(Oc2cc(C)cc(C)c2)nc2ccccn2c1=O 4205491 RUMKALGOYJJDMS-RVDMUPIBSA-N 374.400 2.757 50 40 FFGB O=C(N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 4739437 JBZDQRYAZUFBTL-GIJQJNRQSA-N 361.741 2.783 50 40 FFGB COc1ccc(C(=O)NN)cc1OCc1cccc(Br)c1 226322205 KXEWSYWIMIYDGW-UHFFFAOYSA-N 351.200 2.640 50 40 FFGB C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)c1cccc(C)c1O 4697878 VHPVIIALBXSIPQ-HYARGMPZSA-N 368.437 2.901 50 40 FFGB N#C/C(=C\c1ccccc1OCC(N)=O)C(=O)Nc1cccc(Cl)c1 409223432 HRBQIXUQDFANCZ-MDWZMJQESA-N 355.781 2.750 50 40 FFGB Cc1c(C(=O)N/N=C/c2cc(Cl)ccc2O)sc2ncnc(N)c12 408972862 GVZDTLGVQKRLKB-DENHBWNVSA-N 361.814 2.705 50 40 FFGB CCOc1c(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cccc1OC 33657371 IPGXQMCGJSSPND-UDWIEESQSA-N 355.394 2.816 50 40 FFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(F)cc3)CC2=O)cc1 33336413 OUIKQSWAVQBGJY-BDQMVGTNSA-N 353.397 2.891 50 40 FFGB COc1cc(C(=O)N/N=C\c2ccc(N(C)C)cc2)cc(OC)c1OC 31717446 FOIRZUYWMMVDEI-NDENLUEZSA-N 357.410 2.542 50 40 FFGB COc1cc(C=NNC(=O)CCn2c(C)nc3ccccc32)ccc1O 245239866 MVRAHFMJHPXMTI-UHFFFAOYSA-N 352.394 2.599 50 40 FFGB N#CC1=C(N)Oc2c(ccc3cc(O)ccc23)[C@]12C(=O)Nc1ccccc12 36649123 UIMUWFCUHSHMKD-NRFANRHFSA-N 355.353 2.870 50 40 FFGB CCCCOc1ccc2ccccc2c1/C=N\NC(=O)CN1CCOCC1 409005562 FGGKEYBZLVWXTL-JCMHNJIXSA-N 369.465 2.801 50 40 FFGB Cc1nc2c(c(=O)n1C)[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 20102547 MNUQMEIOUYTDQW-LBPRGKRZSA-N 363.204 2.614 50 40 FFGB CCOc1ccc(Nc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC)cc1 408707588 KSTBATQBSQXDNW-SRZZPIQSSA-N 374.828 2.678 50 40 FFGB CSc1ccc(/C=N/NC(=O)CN2C[C@@H](c3ccccc3)CC2=O)cc1 408974383 YYIARVRESTVWOH-RHLNUJDMSA-N 367.474 2.875 50 40 FFGB O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccc2c(c1)OCCO2 6220283 KMFIQQXTSDIZKU-UHFFFAOYSA-N 370.449 2.825 50 40 FFGB Cc1ccc(-c2nnc(CCC(=O)NNC(=O)c3ccc(C)s3)o2)cc1 9314307 CTGLYJPRDLDHNI-UHFFFAOYSA-N 370.434 2.809 50 40 FFGB CC(=O)O[C@@]12[C@H]3[C@@H]4C[C@H]5[C@@H]([C@H]4[C@H]1Br)[C@H]2[C@H](Br)[C@H]53 245232067 OWYYCXRWCMJAHL-LBLNJYJTSA-N 362.061 2.587 50 40 FFGB COC(=O)/C(=N\NC(=O)c1ccccc1O)[C@@H](C#N)c1ccc(Cl)cc1 5722466 RUMLQRVPIXXRHO-FJGOLAJPSA-N 371.780 2.612 50 40 FFGB Cc1ccsc1/C=N\NC(=O)CNC(=O)C12CC3CC(CC(C3)C1)C2 17143992 BKXJCOXNJBZBMQ-FBHDLOMBSA-N 359.495 2.839 50 40 FFGB O=C(Cn1cnc2ccccc21)NNC(=O)c1cc(Cl)cc(Cl)c1 17404159 PROIHMKDWVYCRW-UHFFFAOYSA-N 363.204 2.804 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C\c2cn(CC(N)=O)c3ccccc23)cc1 107838603 FONNLYKPFLCNBC-UVTDQMKNSA-N 374.400 2.681 50 40 FFGB CC1=C(C(=O)c2ccccc2)[C@]2(C(=O)Nc3ccccc32)C(C#N)=C(N)O1 1054624 QIVBTMVLJLAQHK-OAQYLSRUSA-N 357.369 2.757 50 40 FFGB N#CC1=C(N)N(c2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)C1(C#N)C#N 1296830 RSKVNGROIVCQOQ-KRWDZBQOSA-N 356.345 2.884 50 40 FFGB O=C(CN1CCCC1)N/N=C/c1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1 4525832 DKYCYGOPZLXJKR-DEDYPNTBSA-N 368.393 2.933 50 40 FFGB Cn1/c(=N\NC(=O)c2ccc(NC(=O)C3CC3)s2)sc2ccccc21 96936030 HEDCKUBIERCCNK-LVZFUZTISA-N 372.475 2.896 50 40 FFGB O=C(N/N=C\c1cccc([N+](=O)[O-])c1)C(F)(F)C(F)(F)C(F)(F)F 32115802 VBPGZSGPDSYTEZ-IPKBDRFQSA-N 361.173 2.878 50 40 FFGB O=C(O)c1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 408966565 PEPAGKNUFUWBBY-GIJQJNRQSA-N 353.290 2.803 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 826013 MZUIIYVTSBQIIK-SVZNOHIVSA-N 351.406 2.507 50 40 FFGB CC1(C)CC(=O)C(=CNNC(=O)c2cccc(Br)c2)C(=O)C1 3102217 AQQWMOGAJGIMLT-UHFFFAOYSA-N 365.227 2.526 50 40 FFGB CCSC1=C(C#N)[C@H](c2ccccc2[N+](=O)[O-])[C@@H](C(=O)OC)C(O)=N1 841866 OWZPJQRAKBMHDO-QWHCGFSZSA-N 361.379 2.926 50 40 FFGB C#CCOc1c(/C=C(\C#N)C(N)=S)cc(Br)cc1OC 408544303 VFKSSKKPNYYMHG-BJMVGYQFSA-N 351.225 2.663 50 40 FFGB C=CCN1C(=O)/C(=N\NC(=O)COc2c(C)cccc2C)c2ccccc21 4575170 AUJKVQNNJLABEZ-NMWGTECJSA-N 363.417 2.735 50 40 FFGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccc(O)c(O)c1 8812661 MKVCISHYBGKPAZ-CAOOACKPSA-N 365.183 2.633 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2ccc(CN3CCOCC3)cc2)cc1 23358531 MHVXLHYIYQIMDZ-PXLXIMEGSA-N 367.449 2.681 50 40 FFGB N#C/C(=C\N1CCN(c2ccc(F)cc2)CC1)C(=O)NCc1ccccc1 5487381 HCMGCRJEPOSGNM-FBMGVBCBSA-N 364.424 2.672 50 40 FFGB N#Cc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)sc2N)cc1 9950652 NFXWYGRXFACTCU-UHFFFAOYSA-N 362.414 2.944 50 40 FFGB COc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)CCl)cc1 408907739 QKKQHZASWLKSDA-UHFFFAOYSA-N 368.842 2.982 50 40 FFGB COc1ccc(/C=N/NC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1O 8558463 SWBRSXKEGLQNKG-RGVLZGJSSA-N 355.394 2.759 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC3CCCC3)c2C)cc1 408833445 SKTKBVBTBAXUSP-LPYMAVHISA-N 366.465 2.911 50 40 FFGB CNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1Nc1cccc(Cl)c1 408709310 ZHOGNVYENURQBY-AWQFTUOYSA-N 365.220 2.933 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=C(\C#N)C(=O)n1nc(C)cc1C 409383590 XPSPJDGFEQVKAQ-OQLLNIDSSA-N 350.334 2.668 50 40 FFGB Cc1cc(C)c(OCC(=O)N/N=C\c2ccncc2)c(Br)c1 30900896 CSHWDQJSZXKUMO-OCKHKDLRSA-N 362.227 2.990 50 40 FFGB COc1cccc(NC(=O)/C(C#N)=C\c2cn(CC(N)=O)c3ccccc23)c1 35352773 AUVMNTNCRLTELF-ZROIWOOFSA-N 374.400 2.681 50 40 FFGB CC1=C(/C=C/C(C)=N/NC(=O)N[C@@H]2CCS(=O)(=O)C2)C(C)(C)CCC1 585145917 DCCXEIGOHAGHAK-MZQIPAKUSA-N 367.515 2.931 50 40 FFGB N#Cc1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 1206727 YJRDQGPEFJODNP-LFVJCYFKSA-N 355.397 2.944 50 40 FFGB O=C(CCl)NCCN1C(=O)S/C(=C/c2ccccc2Cl)C1=O 3250328 MMNJZTLOJQQFRT-YRNVUSSQSA-N 359.234 2.731 50 40 FFGB C/C(CCc1ccco1)=N/NC(=O)CNc1cccc(N2CCCC2=O)c1 5260576 IJSSJWYDCSLVAZ-JCMHNJIXSA-N 368.437 2.943 50 40 FFGB Cc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)c2cccc(C)c2)C(C)C)cc1 2645779 LYWVUPQRQCDFBV-SFHVURJKSA-N 367.449 2.519 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OC)c([N+](=O)[O-])c2)cc1 171752897 SSNBILJWLFDWKY-DHDCSXOGSA-N 367.361 2.835 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)c2ccccc2O)c2cc(Cl)ccc21 16712637 SYONLSUPUZQPLV-SILNSSARSA-N 357.797 2.936 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(O)c(OC)c2)c(OC)c1 408884827 VLWZDWVKJLNPRO-OVCLIPMQSA-N 368.389 2.641 50 40 FFGB CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ncnc2ccccc12 1775970403 AQQHSHVOAOFCFK-AWEZNQCLSA-N 359.430 2.622 50 40 FFGB O=C(CCNC(=O)c1ccccc1Cl)N/N=C/c1ccc([N+](=O)[O-])cc1 2675806 KVEZISQRKJDGIG-RGVLZGJSSA-N 374.784 2.518 50 40 FFGB CCOc1ccc(/C(C)=N\NC(=O)C2CC2)cc1Cn1ccsc1=N 102221686 YAPHHJYNRSEEPZ-RFTCXZOSSA-N 358.467 2.726 50 40 FFGB O=C(CSc1ncccn1)N/N=C/c1cc(Cl)cc(Cl)c1O 1059732 NKEOCHLJNFDBDH-NGYBGAFCSA-N 357.222 2.731 50 40 FFGB Cc1cc(C)n(CCC(=O)NNC(=S)Nc2ccc(Cl)cc2)n1 5793203 SQOBUSOOYHEAIU-UHFFFAOYSA-N 351.863 2.561 50 40 FFGB CC(C)=NNC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(C)cc1 408786694 UTKOQXDFSMRFES-UHFFFAOYSA-N 359.451 2.702 50 40 FFGB CCOc1ccccc1[C@@H]1C(C(=O)OC)=C(C)N=C2SC(C#N)=C(N)N21 408604466 JOWWDNGGFYQQBG-OAHLLOKOSA-N 370.434 2.643 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)C2(c3cccc(C)c3)CCC2)c1 40050441 RFPWMZBLSBBELJ-UHFFFAOYSA-N 368.433 2.895 50 40 FFGB COC(=O)/C(=N/NC(=O)c1ccccc1O)[C@H](C#N)c1ccc(Cl)cc1 17197173 RUMLQRVPIXXRHO-HDOZFUISSA-N 371.780 2.612 50 40 FFGB COC(=O)c1ccc([C@@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC(C)(C)C)cc1 803891 XGTMGMYOCDBSGA-MRXNPFEDSA-N 370.405 2.897 50 40 FFGB COC(=O)c1ccc(/C=N\NC(=O)c2c(C)nc3cc(C)ccn23)cc1 59435501 CVRQLNNLOMFMIT-JAIQZWGSSA-N 350.378 2.502 50 40 FFGB CCOc1ccccc1N1C[C@@H](C(=O)NN(C)c2ccccc2)CC1=O 58356235 DAJHMQOPPKCSEA-HNNXBMFYSA-N 353.422 2.606 50 40 FFGB C/C(=N/NC(=O)c1ccoc1C)c1ccc(NC(=O)CCCC(=O)O)cc1 4507185 DQRWQCZCBIJONO-MTJSOVHGSA-N 371.393 2.935 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)cc2c1OCCO2 7156923 XEELMYMTOVPLGV-CXUHLZMHSA-N 350.374 2.690 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCCC1)c1ccccc1F 408879490 GMMXWEZLNXVYQP-UHFFFAOYSA-N 369.462 2.808 50 40 FFGB COc1ccc([C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3I)cc1 5046488 KJZGQLKFWYXPAD-JAYDOHCTSA-N 370.186 2.774 50 40 FFGB C[C@H](Br)C(=O)Nc1ccccc1C(=O)N1CCSCC1 3138448 QQCNEXLPXGKQGS-JTQLQIEISA-N 357.273 2.598 50 40 FFGB NNC(=O)c1cn(-c2ccccc2)nc1-c1ccc(Br)cc1 3193604 KZZDQTMPFNKGHD-UHFFFAOYSA-N 357.211 2.905 50 40 FFGB O=C(COc1ccc2ccccc2c1)NNC(=O)c1ccc([N+](=O)[O-])cc1 829246 IABFDDNEPOYCSP-UHFFFAOYSA-N 365.345 2.588 50 40 FFGB Cn1c(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(Cl)c1Cl 32674719 COGSBKCGHDYIBM-UHFFFAOYSA-N 365.220 2.817 50 40 FFGB CCOC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1cccs1 24977415 MEJMJZLYGLOXEE-UHFFFAOYSA-N 356.407 2.992 50 40 FFGB CC(C)(C)OC(=O)N/N=C/c1ccc(O)c(I)c1 2306439 FDAKGMUQYVXSEV-VGOFMYFVSA-N 362.167 2.855 50 40 FFGB Cn1c(=O)n(C)c2cc(/C=C(/C#N)C(=O)NCCCc3ccccc3)ccc21 409233050 DAHFXRJVYSNOJU-AQTBWJFISA-N 374.444 2.533 50 40 FFGB CC(C)COc1ccc(C(=O)NNC(=O)c2ccc3[nH]cnc3c2)cc1 6653900 SBHVJNUIIGHYPJ-UHFFFAOYSA-N 352.394 2.673 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2O)cc1 408883582 RKULRYOHHSPGRY-NTEUORMPSA-N 352.346 2.733 50 40 FFGB O=C(NNC(=O)c1ccc(-c2ccccc2F)o1)c1ccc2c(c1)OCO2 7785563 AINVEKHNZDHWKE-UHFFFAOYSA-N 368.320 2.889 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccccc2OC)c(OC)c1 408867585 LQXLYJWEOTYDRF-MHWRWJLKSA-N 352.390 2.936 50 40 FFGB CC(C)[C@H](Br)C(=O)Nc1cc2nc(O)[nH]c2cc1N(C)C 408534937 WVXUCUQYDWARNC-LBPRGKRZSA-N 355.236 2.693 50 40 FFGB COc1cccc(Nc2nnc(SCC(=O)/C(C#N)=C(/C)N)s2)c1 104465713 KLBDSTGVKZCJQN-XFXZXTDPSA-N 361.452 2.708 50 40 FFGB COc1ccccc1/C=N/NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1 3071384 JVIYWPHBNBAWLD-UFFVCSGVSA-N 365.311 2.803 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1c1ccc([N+](=O)[O-])s1 1830789 IDMGEJZKKITHKR-ZDUSSCGKSA-N 367.342 2.981 50 40 FFGB OC[C@@H](I)C[C@@](F)(OC(F)(F)F)C(F)(F)F 2573966 KPABQJYHRYTITM-IUYQGCFVSA-N 370.002 2.937 50 40 FFGB COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c1C 408541543 GPNTZXFHIVHCFZ-YVLHZVERSA-N 367.405 2.995 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@@H]1CC(=O)N(c2ccc(C)c(C)c2)C1 409170040 SBBWRJFLUXXCAQ-ORWNMUSCSA-N 365.433 2.815 50 40 FFGB CC(C)C(=O)N/N=C1\C(=O)N(C2CSC2)c2ccc(C(F)(F)F)cc21 223745377 GOFOXJMODRRJFB-MOSHPQCFSA-N 371.384 2.644 50 40 FFGB Cn1cnc(S(=O)(=O)N2CCC[C@H](O[Si](C)(C)C(C)(C)C)C2)c1 585138633 UGAJKAFDNCPEGD-ZDUSSCGKSA-N 359.568 2.595 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@]2(C)NC(C)(C)Cc3ccccc32)cc1 19534959 NKJHWXBXVJQONI-XOWGOQOESA-N 351.450 2.985 50 40 FFGB O=C(O)[C@@H](Br)[C@@H](Br)c1ccc([N+](=O)[O-])cc1 1737468 FZSNEPIHJADWSK-YUMQZZPRSA-N 352.966 2.879 50 40 FFGB in-vitro NNC(=O)c1ccc(Br)c(-c2cc3ccccc3oc2=O)c1 226357652 BEUGIDSPOZFZSI-UHFFFAOYSA-N 359.179 2.826 50 40 FFGB N#C/C(=C\N1CCN(Cc2ccccc2)CC1)C(=O)NCCc1ccccc1 20572543 XHSQZXSAQKEXFZ-ZBJSNUHESA-N 374.488 2.571 50 40 FFGB N#Cc1ccccc1OCC(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 1445079 ZALJYWZIARVDAT-DJKKODMXSA-N 358.741 2.649 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)COc2ccc(C)cc2)c2ccccc21 5739143 GYDJQJDNUNVLLZ-QOCHGBHMSA-N 351.406 2.651 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccccc1OC 408603292 FMPQWVFNAYZWCZ-OAHLLOKOSA-N 370.434 2.643 50 40 FFGB COc1ccc(NC(=S)NNC(=O)CNc2ccc(Cl)cc2)cc1 13544340 FEOHDJKTMGABJG-UHFFFAOYSA-N 364.858 2.778 50 40 FFGB O=C(COc1ccccc1F)NNC(=O)Cc1ccc(Cl)cc1Cl 8350555 XPPQAVSFFGXBKF-UHFFFAOYSA-N 371.195 2.901 50 40 FFGB O=C(NNC(=O)c1cccc(F)n1)N[C@@H]1C[C@H]1c1cccc2ccccc12 1564658618 ZIXPWFPECKYHOX-DOTOQJQBSA-N 364.380 2.874 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)N2CCCC2)c(Br)cc1O 193407766 GBJIQNBWDKXSOT-IZZDOVSWSA-N 351.200 2.693 50 40 FFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)c2ccccc2C)c2ccccc21 5866768 QUVXQBLZINIFLO-QOCHGBHMSA-N 364.449 2.775 50 40 FFGB CCCN1C(=O)/C(=N/NC(=O)c2ccccc2O)c2cc(Cl)ccc21 100180628 SYONLSUPUZQPLV-CAPFRKAQSA-N 357.797 2.936 50 40 FFGB Cc1sc2ncn(CC(=O)N/N=C\c3cccc(Cl)c3)c(=O)c2c1C 31783375 QHUWKRSTAUVGDG-SCDVKCJHSA-N 374.853 2.879 50 40 FFGB C[C@H](C(=O)NN=Cc1c[nH]c2ccccc12)n1cnc2ccccc2c1=O 11847606 IMVYDLSZFTZSSH-CYBMUJFWSA-N 359.389 2.589 50 40 FFGB O=S1(=O)CCc2ccccc2[C@@H](Br)[C@H]1Br 1653741 CBWQIAZOKMCABI-ZJUUUORDSA-N 354.063 2.815 50 40 FFGB C[C@]1(CCc2ccc(N(CCCl)CCCl)cc2)NC(=O)NC1=O 2009117 VLFIDJLUELONPV-MRXNPFEDSA-N 358.269 2.501 50 40 FFGB CCOc1ccccc1/C=N/NC(=O)C(=O)NCc1ccc(Cl)cc1 7812082 QGUMXZANSLGCBT-CIAFOILYSA-N 359.813 2.505 50 40 FFGB C[C@H](OC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1)C(=O)NCc1ccco1 97673954 GYFDMPUSXUGRGN-HNDQUVLASA-N 367.405 2.501 50 40 FFGB O=C(N/N=C/c1ccccc1Cl)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 409151755 BZJKPYTWQBFUJY-IMRMQAIZSA-N 359.788 2.982 50 40 FFGB COc1ccc(C(=O)/C=C(/C)NNC(=O)c2ccc(N(C)C)cc2)cc1 408955174 OEETXZTXUBBJAA-YPKPFQOOSA-N 353.422 2.782 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)ccc1OC(C)C 5633334 WKRNFHRMRDKEMK-KEBDBYFISA-N 356.378 2.975 50 40 FFGB C/C(=N\NC(=O)Cc1c(C)nc(-c2ccccc2)[nH]c1=O)c1ccccc1 9331294 KCOTXJLARFHADX-ZVHZXABRSA-N 360.417 2.828 50 40 FFGB Cc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCCNC2=O)c(C)n1CCC(C)C 98055089 LVTBPKLNNJPFJG-GQEMFKIVSA-N 370.497 2.843 50 40 FFGB N#C/C(=C\c1ccc(I)o1)C(=O)NCc1ccco1 408734719 ITPMNGXZONCWOP-RMKNXTFCSA-N 368.130 2.701 50 40 FFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(OC(C)C)cc1O 408592029 XDMIATFCPUAAOI-VXLYETTFSA-N 373.365 2.860 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1ccc(OC)c(Br)c1 7165291 WGYNDGBLJRMDGB-XYOKQWHBSA-N 353.216 2.517 50 40 FFGB O=C(CCc1ccc(O)cc1)N/N=C/c1cc(Br)ccc1O 1726834 NFVDIJBWLQZOKN-VCHYOVAHSA-N 363.211 2.943 50 40 FFGB O=C(COc1ccc(Cl)cc1)N/N=C/c1ccc(N2CCOCC2)cc1 6407069 GSOFMZFMEVICDZ-FYJGNVAPSA-N 373.840 2.706 50 40 FFGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1cc([N+](=O)[O-])ccc1Cl 226368030 HUHIMOZFCQJSQY-UHFFFAOYSA-N 372.768 2.803 50 40 FFGB CCCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 672487 NRBRXMJKZBRPMQ-RGVLZGJSSA-N 353.378 2.918 50 40 FFGB O=C(CCSc1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 12679647 KNCOEJZHKVUAAQ-UHFFFAOYSA-N 363.370 2.677 50 40 FFGB C=CCc1ccc(OCCOc2ccc(/C=N/NC(N)=O)cc2)c(OC)c1 4550675 FJHAKUHTEQQFIJ-HYARGMPZSA-N 369.421 2.884 50 40 FFGB COc1ccc(N[C@H](C)C(=O)N/N=C(/C)c2ccc([N+](=O)[O-])cc2)cc1 4619326 MCZJXCZTDMPGGW-UAAGNOOKSA-N 356.382 2.944 50 40 FFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2OCC)CC(=O)N1 9110467 WBIDNASKOGZPEU-ZDUSSCGKSA-N 360.435 2.720 50 40 FFGB CCOC(=O)COc1cc(/C=N\NC(=O)c2cccc(C)c2)ccc1OC 409208107 AYCNMPVVCMFHTA-MTJSOVHGSA-N 370.405 2.709 50 40 FFGB NC(=O)COc1ccc(/C=N/NC(=O)c2cc3cc(Cl)ccc3o2)cc1 408962848 KFALEYNHPGLLNW-ZVBGSRNCSA-N 371.780 2.714 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)n1cc(C(=O)NN)c2ccccc21 216775680 BPXFWYRGNHBHTP-UHFFFAOYSA-N 357.797 2.926 50 40 FFGB COc1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc(Cl)c1O 109283652 DURCVAUVGISPSV-NVMNQCDNSA-N 363.757 2.655 50 40 FFGB Oc1ncc(N/N=C\c2ccc(N(CCCl)CCCl)cc2)c(O)n1 104385551 OHVCDKPZSFASGV-OCKHKDLRSA-N 370.240 2.618 50 40 FFGB O=[N+]([O-])c1ccc([C@H]2[C@@H]3C[C@H]4[C@H](OO[C@@H]42)[C@@H]3I)cc1 104068044 OPAZSUHPECXLGD-FQIARQCESA-N 373.146 2.831 50 40 FFGB CC(=O)c1c(NNC(=O)c2ccc(-n3cccc3)cc2)oc(C)cc1=O 27300525 MGUQYHGKDLIUOT-UHFFFAOYSA-N 351.362 2.698 50 40 FFGB COc1cccc(OC)c1/C=N/NC(=O)c1c(C)nc2cc(C)ccn12 408963372 ALJDMWIKVLTLDZ-RGVLZGJSSA-N 352.394 2.732 50 40 FFGB O=C1c2ccc(I)c(F)c2O[C@@H]1Br 103571616 KPJLRAWYPIGUOA-QMMMGPOBSA-N 356.916 2.726 50 40 FFGB O=c1[nH]c(SSc2nc3ccccc3c(=O)[nH]2)nc2ccccc12 5324068 HLWVRWAMTHJYGL-UHFFFAOYSA-N 354.416 2.959 50 40 FFGB CC(C)OC(=O)COc1ccc(/C=N/NC(=O)c2ccc(F)cc2)cc1 6327963 UDSWVENAZNWRHH-SRZZPIQSSA-N 358.369 2.920 50 40 FFGB CCOC(=O)[C@](CCC(=O)O)(CCC(C)C)C(=O)CBr 2322833 KOEVCUOEWPTRGU-AWEZNQCLSA-N 351.237 2.801 50 40 FFGB COc1ccc(CC(=O)NNC2=CC(=O)C[C@@H](c3ccccc3)C2)cc1 408751488 PLEVWMVAEUNFKC-KRWDZBQOSA-N 350.418 2.889 50 40 FFGB C/C(=N/NC(=O)[C@@H](O)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 4155721 JHMAVHNCLBGAOE-FPJJECCMSA-N 351.406 2.609 50 40 FFGB CC(C)N1C(=O)/C(=N/NC(=O)COc2cccc(Cl)c2)c2ccccc21 5690194 WQMACBQKHAYQPK-RELWKKBWSA-N 371.824 2.994 50 40 FFGB C[C@]1(O)NC(S)=C(C#N)[C@@H](c2ccc(Cl)cc2)[C@@H]1[n+]1ccccc1 20459099 UUHKKRHAOIPVPD-SOLBZPMBSA-O 358.874 2.929 50 40 FFGB O=C(CCC(=O)N/N=C/[C@@H]1C[C@@H]2CC[C@H]1C2)N/N=C/[C@H]1C[C@H]2CC[C@H]1C2 103623208 NXDNIKYHOJFYMV-RCRDYREJSA-N 358.486 2.843 50 40 FFGB C/C(CC(=O)Nc1ccc([N+](=O)[O-])cc1)=N/NC(=O)[C@@H]1[C@H]2CCCC[C@H]21 245377205 IVOGQQSWWHBBJF-MKRADACGSA-N 358.398 2.852 50 40 FFGB Cc1ccc(NCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N(C)C)cc1C 4119031 MRMXJTCUIQUBIW-SRZZPIQSSA-N 369.425 2.840 50 40 FFGB CN1CCN(C(=S)SC/C(O)=C(\C#N)c2nc3ccccc3[nH]2)CC1 104160984 QEZZXDNUHKAUKS-QINSGFPZSA-N 373.507 2.621 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)c1cccc2ccccc12 722544 DMFCWQNLDYJOTB-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB CCOC(=O)/C(C#N)=C/c1cn(CCC(=O)O)nc1-c1ccc(F)cc1 3273775 QLVMVYOBDWPPDU-UKTHLTGXSA-N 357.341 2.634 50 40 FFGB CCc1ccc(OCC(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)cc1 5019583 ORSOVFGDRRTUBA-KGENOOAVSA-N 354.406 2.939 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)Cc1ccc(C)c(C)c1 409180343 QXRBEHFTUFRSDV-FYJGNVAPSA-N 365.389 2.916 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1 59473712 GPQRRINLMFEKPQ-DEDYPNTBSA-N 372.446 2.871 50 40 FFGB O=C(NNC(=O)C1CC1)c1cc(Cl)c2cccc(Br)c2n1 78965109 IQWNNAFSGIIDSR-UHFFFAOYSA-N 368.618 2.822 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 409208101 AVZWDMXRAMLFNL-MDWZMJQESA-N 367.317 2.633 50 40 FFGB CC(C)c1ccc(/C=N/NC(=O)CN(c2ccccc2)S(C)(=O)=O)cc1 19954070 UXSCHCOKJOLGPC-DEDYPNTBSA-N 373.478 2.726 50 40 FFGB CCOc1ccc(/C=N\NC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1OC 38344167 QCUZHRMTQBHSDF-MTJSOVHGSA-N 369.421 2.800 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)ccc1OCC(C)C 7159855 YGKFOIWRSUHBFY-NDCSFFLDSA-N 358.438 2.932 50 40 FFGB O=C(Cn1cc(C(F)(F)F)ccc1=O)N/N=C/c1cccc(Cl)c1 3186975 HJCOXDKBIHKNQJ-IFRROFPPSA-N 357.719 2.671 50 40 FFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1ccc(N2CCCC2)cc1 38431000 BZHVXDQRFCEFJQ-XDHOZWIPSA-N 354.366 2.665 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1 5747985 LSLNSIBUDATAAB-UHFFFAOYSA-N 370.449 2.898 50 40 FFGB C/C(=N\NC(=O)COc1cccc(C)c1)c1ccc(N2CCOCC2)cc1 6333515 WIPSZHAJOZQXBF-OQKWZONESA-N 367.449 2.751 50 40 FFGB O=C(N/N=C\c1cc(Br)cs1)[C@@H]1COc2ccccc2O1 13138656 LWWPCMSMTFJTED-KIOONODFSA-N 367.224 2.801 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)CCc2ccccc2)cc1 100544262 XFDLRKPJEIIQJH-XQNSMLJCSA-N 367.449 2.826 50 40 FFGB COc1cc(/C=N/NC(=O)[C@@H](OC)c2ccccc2)cc(OC)c1OC 20228232 HXKAPCCIELFOMH-RONKMWSCSA-N 358.394 2.550 50 40 FFGB COC(=O)[C@](O)([C@@H](Cl)C(=O)Nc1cccc(Cl)c1C)C(F)(F)F 2115268 KFKCVTWBLHBRMR-JOYOIKCWSA-N 374.142 2.661 50 40 FFGB COC(=O)c1cccc(C(=O)[C@@H](Br)CBr)c1 309413210 GNAWJOZTDYGXTM-VIFPVBQESA-N 350.006 2.814 50 40 FFGB C/C(=N/NC(=O)c1c(Br)cnn1C)c1ccc(Cl)cc1 6644741 UEGUMVWRSXYWNU-IUXPMGMMSA-N 355.623 2.990 50 40 FFGB Cc1noc2ncc(C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc12 30892150 SZNVQPYTGVRQLC-UHFFFAOYSA-N 354.410 2.509 50 40 FFGB O=C(NNC(=S)NC(=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 6505703 QGRABVGSGCYGQD-UHFFFAOYSA-N 368.245 2.943 50 40 FFGB C[C@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)c1ccccc1F 9856625 AVBGCCFGSGFVSX-JTQLQIEISA-N 358.398 2.697 50 40 FFGB Cc1cc(C)cc(N(CC(=O)NN=C2CCCCC2)S(C)(=O)=O)c1 408771098 CGSVYGPQUBCKAP-UHFFFAOYSA-N 351.472 2.506 50 40 FFGB O=C(N/N=C/c1ccc(F)s1)c1cc(-c2ccc3c(c2)OCO3)[nH]n1 252494769 OEBIQEIDYAEYTD-CNHKJKLMSA-N 358.354 2.770 50 40 FFGB COc1ccc(C(=O)n2c(C)c(C(=O)NN)c3ccccc32)cc1Cl 226367769 YVTRNUPCZYJLOA-UHFFFAOYSA-N 357.797 2.904 50 40 FFGB CCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccccc2Cl)c1C 8338079 LTCZMKUWGDNFSC-UHFFFAOYSA-N 363.801 2.536 50 40 FFGB C=CCN1C(=O)/C(=N/NC(=O)COc2ccc(C)cc2C)c2ccccc21 5578369 NOZRGKMSVWIEMI-BSYVCWPDSA-N 363.417 2.735 50 40 FFGB COc1ccc(C(=O)N/N=C\c2c[nH]nc2-c2ccc(OC)cc2)cc1 5634362 OMRUOKYPLLODFR-MTJSOVHGSA-N 350.378 2.858 50 40 FFGB O=C(CN1C[C@H](c2ccccc2)CC1=O)N/N=C/c1cccc(Cl)c1 408973956 RNBYGHGWYADRGC-BTZNOAQDSA-N 355.825 2.806 50 40 FFGB COc1cccc(C(=O)N/N=C/c2cccn2-c2cccc(C(=O)O)c2)c1 409102777 FCXARLJPSGQIRM-FYJGNVAPSA-N 363.373 2.948 50 40 FFGB CCOc1ccc(NC(=O)NNC(=O)COc2ccc(CC)cc2)cc1 2532734 ZHGNNMXFARMGLL-UHFFFAOYSA-N 357.410 2.879 50 40 FFGB Cc1cc(C)cc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1 102612211 DRFLLNFZSRTEEU-YRKSKIDTSA-N 364.239 2.813 50 40 FFGB O=C(CC(=O)NC1CCCCC1)N/N=C\c1c(O)ccc2ccccc12 59444508 AHLLMPRVQVCLKY-BKUYFWCQSA-N 353.422 2.835 50 40 FFGB Cc1cccc(C(=O)NNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)c1 12406169 UPKPGVVOALWGNS-SFHVURJKSA-N 354.406 2.628 50 40 FFGB C/C(=N\NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O)C(C)(C)C 20493221 PWPORYWQWUTEPK-GZTJUZNOSA-N 359.879 2.644 50 40 FFGB Cc1cc(/C=C(/C#N)c2nc(N)nc(N(C)C)n2)cc(C)c1OC(F)F 96931770 LUSGMSBQIFHLRG-GHXNOFRVSA-N 360.368 2.802 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc(Br)c1O)c1ccccc1 36166573 HCKKOFWIZKEOTE-PXNMLYILSA-N 364.155 2.827 50 40 FFGB O=C(N/N=C/c1ccc(Br)cc1)C(=O)Nc1ccc(F)cc1 3151055 VIEJQOFWODADDS-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB COc1cc(OC)c([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)c(OC)c1 85409022 NPVBMACTZGCMNY-KRWDZBQOSA-N 354.362 2.636 50 40 FFGB FC(F)(F)C1(C(F)(F)F)[C@H]2C[C@@H]3[C@@H]([C@@H]2I)N31 100122214 DTKNYSHMNMVGAO-LMWUXKPISA-N 357.035 2.740 50 40 FFGB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2 103402776 YAUXVDZNVZLBLS-OWZDWXTDSA-N 373.453 2.617 50 40 FFGB COc1cccc(/C=N/NC(=O)CCC(=O)Nc2ccc(C)c(C)c2)c1O 2134283 SSSWJPMICJVKQD-CIAFOILYSA-N 369.421 2.887 50 40 FFGB Cn1c(SCC(=O)N/N=C/c2ccccc2)nnc1-c1ccccc1 2319658 YVQJLORAUOSOCM-XDHOZWIPSA-N 351.435 2.725 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)OC(C)C)ccc1O[C@@H](C)C(=O)N(C)C 13135231 YZQGHBNIIHBGIK-KNGSKEOJSA-N 374.437 2.799 50 40 FFGB C[C@@H]1C=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3)[C@@]2(C)CN1C 19816152 MNEKLXLKKDRVIN-YHBQJITHSA-N 361.424 2.959 50 40 FFGB C[C@@H]1C=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3)[C@]2(C)CN1C 35212995 MNEKLXLKKDRVIN-ORPRQENYSA-N 361.424 2.959 50 40 FFGB COc1ccccc1OCC(=O)N/N=C\c1ccc(N2CCCC2)cc1 35061291 QKSFWADJJJEGEJ-STZFKDTASA-N 353.422 2.825 50 40 FFGB CC1=C(C(=O)C(C)C)[C@]2(C(=O)Nc3ccc(Cl)cc32)C(C#N)=C(N)O1 1057601 MCFURTBMEYFMGW-GOSISDBHSA-N 357.797 2.753 50 40 FFGB CC[C@@H](NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc(C)on1 28625852 XFNKXWDEHVDQSP-BCFZYGEVSA-N 360.458 2.537 50 40 FFGB O=C(CCCSc1ccccc1)NNC(=O)c1ccc2c(c1)OCO2 3411242 PYBDHQBQKKFIDF-UHFFFAOYSA-N 358.419 2.749 50 40 FFGB NNC(=O)CSc1nnc(-c2cccc(Cl)c2)n1-c1ccccc1 4201757 VDXAAZHHYOSNEW-UHFFFAOYSA-N 359.842 2.670 50 40 FFGB Cc1cc(/C=N/NC(=O)CN2CCOCC2)c(C)n1-c1ccc(Cl)cc1 19851575 WGROSCWERPSNSM-CIAFOILYSA-N 374.872 2.530 50 40 FFGB COc1cc(C)c(/C=N\NC(=O)COc2cccc(N(C)C)c2)cc1OC 408548013 BTNCHYUWBJSYKN-MTJSOVHGSA-N 371.437 2.607 50 40 FFGB COc1cc(/C=C(/C#N)C(N)=S)ccc1OCC(=O)Nc1ccccc1 408544704 WVQYRWSEHOWCDK-ZROIWOOFSA-N 367.430 2.906 50 40 FFGB CC(=O)O[C@@H]1C[C@H]2[C@H](Br)[C@@H]1NC2(C(F)(F)F)C(F)(F)F 33742214 RMADYUJTAOPBEY-BNHYGAARSA-N 370.087 2.537 50 40 FFGB O=C(Nc1ccccc1C(=O)NNC(=O)c1ccco1)c1ccsc1 40017295 NEKBEJMZHCZGQI-UHFFFAOYSA-N 355.375 2.668 50 40 FFGB C=CCOc1cccc(/C=N\NC(=O)Cc2ccc(OC)c(OC)c2)c1 59515928 REDNOLYQPKDUIO-STZFKDTASA-N 354.406 2.961 50 40 FFGB O=C(Cc1c(Cl)cccc1Cl)NNC(=O)c1ccc2c(c1)OCO2 21875058 RLVDCRFXZGIZCR-UHFFFAOYSA-N 367.188 2.726 50 40 FFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(O[C@@H](C)C(=O)O)cc1 59248570 JTZLWZBBSARXRI-HSWQHBDASA-N 356.378 2.619 50 40 FFGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc2c(c1)OCO2 3235824 SGGSSGUTOFEVAY-GZIVZEMBSA-N 365.311 2.996 50 40 FFGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccc([N+](=O)[O-])cc1 3350256 PBQUSFKXDBSWBT-SRZZPIQSSA-N 374.356 2.859 50 40 FFGB Cc1cc(C(=O)N/N=C/c2ccc(-c3ccc([N+](=O)[O-])cc3C)o2)[nH]n1 6187820 RHZSKSYYTVYHHQ-GIJQJNRQSA-N 353.338 2.959 50 40 FFGB CCc1ccc(CC(=O)N/N=C\c2cc([N+](=O)[O-])c(OC)cc2OC)cc1 409363682 MFKWPEKMVIFOAP-NDENLUEZSA-N 371.393 2.867 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)c(O)c([N+](=O)[O-])c1 408569039 YHNKMLOEOGCEFX-VXLYETTFSA-N 357.366 2.619 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2[N+](=O)[O-])cc1 252502386 UPNIJFRNCPTSNC-GXDHUFHOSA-N 351.318 2.927 50 40 FFGB CCCc1nc2c(o1)NC(N)=C(C#N)[C@@H]2c1cc(OC)c(OC)cc1OC 1073799 OBNREJNDAJUHPH-INIZCTEOSA-N 370.409 2.904 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)NC(C)C)cc(Br)c1O 3570634 MGODDYATSIEQHB-VZUCSPMQSA-N 353.216 2.985 50 40 FFGB CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)NNC(=O)c2ccco2)CC1=O 12926485 URURFYZFMNUGQA-KGLIPLIRSA-N 369.421 2.607 50 40 FFGB Cc1ccc(C)c2c1NC(=O)/C2=N\NC(=O)CN1CCCc2ccccc21 84147881 BTDUPWMUNFAKHG-UHFFFAOYSA-N 362.433 2.529 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1O)c1cccc(-n2cccc2)c1 409117386 OJCYVAPVKUNFAT-UNOMPAQXSA-N 350.334 2.855 50 40 FFGB CCc1ccc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)cc1 409026533 ROAMAFOPCHJVPE-UHFFFAOYSA-N 365.499 2.841 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc(Cl)c(O)c(OC)c2)c(OC)c1 8207423 NXAWRPZLYKLPNB-DJKKODMXSA-N 364.785 2.835 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)N/N=C2/C(=O)N(C)c3ccccc32)c1 100436167 SPOUFQOUZGKKQV-BSYVCWPDSA-N 365.433 2.994 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2cccc(C)c2)cc1 4697754 RSGGTMUTNDBBEA-PXLXIMEGSA-N 353.422 2.816 50 40 FFGB O=C(CC(=O)N/N=C\c1cccc(Cl)c1Cl)NCc1cccnc1 58885198 AIFXQPRKHGKDRU-FBHDLOMBSA-N 365.220 2.545 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(C)c1 25068290 INVVLWUREBBNBL-UHFFFAOYSA-N 352.369 2.907 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(OC)cc2)cc1OC 408840303 DHYOITVVDFFDNW-YBFXNURJSA-N 358.350 2.613 50 40 FFGB CCOc1ccccc1NC(=O)NNS(=O)(=O)c1cc(C)ccc1C 7067011 VKLADAVBFFUHSS-UHFFFAOYSA-N 363.439 2.717 50 40 FFGB Cc1occc1C(=O)NNC(=O)c1cccc(NC(=O)c2cccs2)c1 7283438 AEMUUJUJMUIUOE-UHFFFAOYSA-N 369.402 2.977 50 40 FFGB COc1ccccc1OCC(=O)N/N=C\c1cccn1-c1ccc(O)cc1 409014791 JVFXAVSMRLKAOQ-BKUYFWCQSA-N 365.389 2.721 50 40 FFGB C/C(=N\NC(=O)Cc1ccc(Br)cc1)c1ccc(O)cc1O 17877134 XWVUAHZJFXMIRR-VCHYOVAHSA-N 363.211 2.943 50 40 FFGB CCOC(=O)/C(C#N)=C/c1cc(CSc2nnc(N)s2)cs1 8306826 YODKDMTVUYXGFH-RUDMXATFSA-N 352.466 2.944 50 40 FFGB COc1ccccc1NCC(=O)N/N=C(/C)c1ccc(OC)c(OC)c1 4711910 DUASJLGQDISQQI-BKUYFWCQSA-N 357.410 2.665 50 40 FFGB O=C(CC(=O)N/N=C/c1c(F)cccc1Cl)NCCc1ccccc1 4905596 VWDSLLNGSABXPM-WSDLNYQXSA-N 361.804 2.678 50 40 FFGB C[C@H](OC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1)C(=O)NCc1ccco1 6831879 GYFDMPUSXUGRGN-LUYJPIOASA-N 367.405 2.501 50 40 FFGB CCc1ccc(N/C(SCC(N)=O)=C(\C#N)C(=O)N2CCCCC2)cc1 71328586 DCHVQTYEXZJLIE-VLGSPTGOSA-N 372.494 2.627 50 40 FFGB CC(C)=NNC(=O)CN(c1ccccc1C)S(=O)(=O)c1ccccc1 20060529 IACVNNGPHXYGPQ-UHFFFAOYSA-N 359.451 2.702 50 40 FFGB COC(=O)c1cccc(/C=N/NC(=O)c2c(C)nc3cc(C)ccn23)c1 408972394 SSCKJTMBPIVCRF-RGVLZGJSSA-N 350.378 2.502 50 40 FFGB COc1cccc2cc(C(=O)N/N=C/c3ccccc3OCC(=O)O)oc12 4739971 IYROFDGVUFGYMS-KEBDBYFISA-N 368.345 2.669 50 40 FFGB C/C(CC(=O)NC(C)(C)C)=N\NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 14921502 VFASKSMFFZCOPT-GIJQJNRQSA-N 354.794 2.659 50 40 FFGB Cc1cccc(/C=N/NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)c1 408777133 VTCVKEOBUPNCAE-UDWIEESQSA-N 373.478 2.528 50 40 FFGB CCOC(=O)NNC(=O)c1ccc(OCc2cn3cccc(C)c3n2)cc1 36656044 GASGFKBDFZQHAA-UHFFFAOYSA-N 368.393 2.613 50 40 FFGB O=C(N/N=C\c1cc(Cl)cc(Cl)c1O)[C@H]1COc2ccccc2O1 13583927 IRXLKBDYWFIHOB-TZFWNBKVSA-N 367.188 2.989 50 40 FFGB COc1cc(C(=O)N/N=C(/C)c2ccc3c(c2)OCO3)cc(OC)c1OC 6691428 RWKXANNTBZATFP-JAIQZWGSSA-N 372.377 2.595 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)N2CCCCCC2)c(C)n1-c1ccccc1 59566517 YGXVONKLNSHWDB-PXLXIMEGSA-N 366.465 2.947 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/C=C/c1ccc([N+](=O)[O-])cc1 3212125 ODHHDNJSIIOTGZ-DKABEWEPSA-N 370.321 2.697 50 40 FFGB O=[N+]([O-])c1ccc([C@@H]2[C@@H]3C[C@H]4[C@H](OO[C@H]24)[C@@H]3I)cc1 104068038 OPAZSUHPECXLGD-PQWUQFFPSA-N 373.146 2.831 50 40 FFGB CN1C(=O)/C(=N/NC(=O)COc2cccc3ccccc23)c2ccccc21 6057021 QXWAKIYIQRGLMQ-BSYVCWPDSA-N 359.385 2.716 50 40 FFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(C)cc1 408906117 AQJXCYGBNAZINN-ALDSOSFCSA-N 353.422 2.803 50 40 FFGB Cc1ccc(SCCC(=O)N/N=C/c2c(CO)cnc(C)c2O)cc1 7778584 YGWHGZBFEDDZSS-KEBDBYFISA-N 359.451 2.529 50 40 FFGB Cc1ccc(C(=O)NNC(=O)CCc2nnc(-c3ccc(C)cc3)o2)cc1 7959907 QZNVHDKPSSQBTO-UHFFFAOYSA-N 364.405 2.747 50 40 FFGB CCOc1cc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)ccc1O 40545753 NCKYDJHWIXMVAD-GOSISDBHSA-N 352.346 2.738 50 40 FFGB C[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N/N=C1\C=C(O)CCC1 105595978 NKPIZPALWPNIQQ-VZQLWFPFSA-N 359.470 2.806 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2Cl)c1 408609749 RVUHSLLRWIFACP-WSDLNYQXSA-N 371.824 2.671 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(O)c(Br)c2)c(O)c1 409392992 UOYOZPQEXUCKOT-CAOOACKPSA-N 365.183 2.633 50 40 FFGB CCCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(NC(C)=O)cc2)C1=O 13691219 CTVRFYDCPFXARD-PDGQHHTCSA-N 366.421 2.950 50 40 FFGB Cc1cccc(/C=N/NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)c1 408781801 DTBJYAFRTNIPJC-UDWIEESQSA-N 373.478 2.528 50 40 FFGB O=C(CCc1ccc(O)cc1)N/N=C\c1cc(Br)ccc1O 73106034 NFVDIJBWLQZOKN-ZDLGFXPLSA-N 363.211 2.943 50 40 FFGB CC(=O)[C@H]1N(S(=O)(=O)c2ccc(C)cc2)C([C@H](C)Cl)=NC1(C)C 24718452 VLPKNRYRNYLHDY-SMDDNHRTSA-N 356.875 2.761 50 40 FFGB biogenic CCOC(=O)c1c(C)[nH]c(C(=O)N/N=C\c2ccc(OC)c(OC)c2)c1C 33381694 GJZFCLGIUBQRDQ-JMIUGGIZSA-N 373.409 2.589 50 40 FFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=S)NCc1ccco1 4866563 KPBODYQYWRIFET-UHFFFAOYSA-N 374.249 2.661 50 40 FFGB COc1cccc(/C=N/NC(=O)CSc2nc3ccccc3o2)c1O 1818013 DMTYWBOXTPQNBL-GIJQJNRQSA-N 357.391 2.784 50 40 FFGB Cc1cc(C)c(NCC(=O)NNC(=O)CCc2ccccc2O)c(C)c1 8721502 BMFMKVPZSKCGTI-UHFFFAOYSA-N 355.438 2.510 50 40 FFGB Cc1ccc(-c2nnc(SCC(=O)NN)n2-c2ccc(C)cc2)cc1 36724706 KSZBEJBDBWKQIA-UHFFFAOYSA-N 353.451 2.633 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2cccc(C)c2)c(OC)c1OC 1052016 KHQNOZPBKVDKLM-RGVLZGJSSA-N 358.394 2.550 50 40 FFGB CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C3CC3)cc2)cc1 2630795 GLXJXUZBIQDRLF-UHFFFAOYSA-N 354.406 2.835 50 40 FFGB O=C(N/N=C/c1ccncc1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 58884683 OVQSGQDHWKRELA-ODCIPOBUSA-N 370.718 2.843 50 40 FFGB Cc1ccc(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)cc1C 8474879 SSEYSTVHQULNHX-HGPDSQILSA-N 364.239 2.813 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1ccc(NC(=O)c2ccco2)s1 12905553 MDENOFYFYRCFBA-UHFFFAOYSA-N 369.402 2.597 50 40 FFGB N#C/C(=C\c1ccc(OCCC(=O)O)cc1)C(=O)NCCc1ccccc1 46861435 MLUCIFTZSNFTBT-NBVRZTHBSA-N 364.401 2.806 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc(Cl)cc3)CC2=O)cc1 1421513 UVCTUJUQMPLIHN-VPNURPJOSA-N 371.824 2.852 50 40 FFGB Cc1ccc(N2C(=O)C[C@@H](NNC(=O)c3cccc(Cl)c3)C2=O)c(C)c1 2248499 XCLLTWOHKRCWIK-OAHLLOKOSA-N 371.824 2.523 50 40 FFGB CC1(C)CC(=O)C2=C(C1)N1CCc3ccccc3[C@H]1C/C2=N\NC(N)=O 4029277 KRJRTJDGLJQBTE-QQHUYRGFSA-N 352.438 2.657 50 40 FFGB biogenic CCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)cc1OCC 5408582 GXOBSDDRXLXGDG-INIZCTEOSA-N 370.409 2.572 50 40 FFGB COc1ccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c(OC)c1 408712650 FDUQPQFQWZCGAY-UHFFFAOYSA-N 370.796 2.789 50 40 FFGB N#C/C(=C/c1cn(CC(N)=O)c2ccccc12)C(=O)Nc1ccc(F)cc1 409385903 OGSGZGPJWVMSLS-LCYFTJDESA-N 362.364 2.811 50 40 FFGB COC(=O)C(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccccc1 36559250 XBKSHKYODKRLSU-INIZCTEOSA-N 360.369 2.648 50 40 FFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1 6293796 UJMJPIRCFBOWQD-UFWORHAWSA-N 359.769 2.791 50 40 FFGB Cc1ccccc1OCC(=O)N/N=C1\C(=O)N(C(C)C)c2ccccc21 6056207 ZALMTKQVWSKGRS-QOCHGBHMSA-N 351.406 2.649 50 40 FFGB Cc1ccc(C(=O)NNC(=O)CCC(=O)Nc2ccc(C)cc2C)cc1 4592092 HJFWKPSILSBILL-UHFFFAOYSA-N 353.422 2.792 50 40 FFGB C/C(=N\NC(=O)c1ccc(C)cc1O)c1cccc(N2CCOC2=O)c1 98055525 YHOOWGNDWUXJGB-DEDYPNTBSA-N 353.378 2.811 50 40 FFGB O=C(NNc1ncnc2c1cnn2-c1ccccc1Cl)c1ccco1 35586501 WPGYLPBHMDQVMO-UHFFFAOYSA-N 354.757 2.819 50 40 FFGB CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NN(C)c2ccccc2)cc1 11354918 OTRHQZCTFRGNHQ-CQSZACIVSA-N 361.467 2.545 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccc([N+](=O)[O-])c2)cc1 408795154 LIJWRXJTRBOOOM-NTEUORMPSA-N 351.318 2.927 50 40 FFGB O=C(CN1C[C@@H](c2ccccc2)CC1=O)N/N=C/c1cccc(Cl)c1 408973957 RNBYGHGWYADRGC-XYHOIZSOSA-N 355.825 2.806 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C\c2cc([N+](=O)[O-])cc(OC)c2O)cc1 408745043 JIDYQCVDEDMVTA-GHXNOFRVSA-N 369.333 2.863 50 40 FFGB Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)NNC(=O)c1ccco1 16154814 NCEOLLZLELUCKV-UHFFFAOYSA-N 350.440 2.817 50 40 FFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1cccc([N+](=O)[O-])c1 3088356 TWSUFBCNWUHDQZ-RQZCQDPDSA-N 374.378 2.887 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C\c2cccc(OCC(=O)O)c2)cc1 409073318 MFTBWWYAWLMJKB-ZROIWOOFSA-N 352.346 2.704 50 40 FFGB COc1ccc(OCC(=O)N/N=C\c2ccc(N3CCCC3)cc2)cc1 207287575 DXHNRQSJUCQWQA-STZFKDTASA-N 353.422 2.825 50 40 FFGB CCOC(=O)c1cc(C(=O)N/N=C/c2ccc(N(C)C)cc2)c(C)nc1C 2696829 LWIAHVYZRYSHGP-CIAFOILYSA-N 368.437 2.705 50 40 FFGB COc1ccc2nc(NNC(=O)[C@@H]3COc4ccccc4O3)sc2c1 4121403 WMUSQYLMHZGLIQ-AWEZNQCLSA-N 357.391 2.588 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1cccc(OC)c1 4502863 CPASEJQBEWGUSA-OAHLLOKOSA-N 370.434 2.643 50 40 FFGB CN1[C@@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@@H](c4cccc(F)c4)[C@@H]3[C@H]1CC2 4730549 HSQSGIPRWNRTCY-VLQPXKRTSA-N 359.408 2.712 50 40 FFGB COCc1[nH]nc2c1[C@H](c1ccc(OC(F)(F)F)cc1)C(C#N)=C(N)O2 808952 BOZKORXKMUAYSZ-GFCCVEGCSA-N 366.299 2.673 50 40 FFGB CCOc1cc([N+](=O)[O-])cc(/C=N/NC(=O)CNc2ccccc2C)c1O 36123264 WSVNQBKXFDGHQT-KEBDBYFISA-N 372.381 2.570 50 40 FFGB O=C(N/N=C/c1cccc(OC2CSC2)c1)c1cccc([N+](=O)[O-])c1 408837898 PKDAVNXUGDRGPA-GIJQJNRQSA-N 357.391 2.853 50 40 FFGB O=C(CN1C(=O)COc2ccccc21)NNc1cccc(C(F)(F)F)c1 12816377 JZNBGNUZBALTBR-UHFFFAOYSA-N 365.311 2.574 50 40 FFGB Cn1cccc1C(=O)NNC(=S)NCCSc1ccc(Cl)cc1 7785052 GMWLUQNTGVFBBV-UHFFFAOYSA-N 368.915 2.580 50 40 FFGB N#C/C(=C\N1CCN(c2ccccc2)CC1)C(=O)Nc1ccc(F)cc1 30791203 UBYKLIZFNZOZQF-FOCLMDBBSA-N 350.397 2.994 50 40 FFGB N#CC1=C(N)Oc2cc(N)ccc2[C@@H]1c1cc(Br)ccc1O 16788557 AWVPTFNJQKQMDZ-OAHLLOKOSA-N 358.195 2.955 50 40 FFGB Cc1ccc(NNC(=O)c2cccc(NS(C)(=O)=O)c2)cc1Cl 30537964 KDRWTAITBPRFIQ-UHFFFAOYSA-N 353.831 2.777 50 40 FFGB CCCCN1C(=O)/C(=N\NC(=O)COc2ccccc2)c2ccccc21 6778854 GAXMUANQCGJSRK-QOCHGBHMSA-N 351.406 2.733 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 6962051 QNAIKPLJSOWRMG-WMRWHDLOSA-N 351.406 2.589 50 40 FFGB Cc1csc([C@](O)(CC(=O)NNc2ccc(F)cc2)C(F)(F)F)n1 58792215 KOACBFAIBBRNPL-CYBMUJFWSA-N 363.336 2.874 50 40 FFGB CC(C)(C)OC(=O)NCc1ccc(C(=O)NNC(=O)OC(C)(C)C)cc1 17398935 MWIPVXHDGZSULF-UHFFFAOYSA-N 365.430 2.881 50 40 FFGB CC(=O)n1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 4503146 PGKLLNVHWVTDLB-VXLYETTFSA-N 350.334 2.974 50 40 FFGB COc1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1OC 5676102 ZZJPNUBIYXUDLT-UHFFFAOYSA-N 358.438 2.681 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)NC2CCCCCC2)cc1OC 409007848 ZQTPCTOFGOMOFO-KGENOOAVSA-N 373.453 2.549 50 40 FFGB N#C/C(=C\c1cc(Cl)ccc1OCC(N)=O)C(=O)Nc1ccccc1 409227263 XRIQZYSRQIYVKQ-MDWZMJQESA-N 355.781 2.750 50 40 FFGB N#CSc1ccc(NC(=O)CSc2nnnn2-c2ccccc2)cc1 717859 AYZBNBYSEWKRTR-UHFFFAOYSA-N 368.447 2.966 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1 5006523 NFEMUUYKWONEEM-XYOKQWHBSA-N 374.780 2.968 50 40 FFGB COc1ccc(-c2nnc(SCC(=O)/C(C#N)=C(\C)N)n2C(C)C)cc1 25423719 JXXVPFNTZKOQGU-NTCAYCPXSA-N 371.466 2.952 50 40 FFGB NNC(=O)c1csc(-n2nc(C(F)(F)F)cc2-c2cccs2)n1 1412631 FKJRTRIHQQZZHI-UHFFFAOYSA-N 359.358 2.680 50 40 FFGB COc1ccccc1OCCC(=O)NNC(=O)c1cc2c(s1)CCCC2 3433248 XQDRZJFYSFBXIB-UHFFFAOYSA-N 374.462 2.866 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O)c1cccs1 5582333 JRJOMZWOGWQPPB-MKMNVTDBSA-N 370.184 2.888 50 40 FFGB O=C(N/N=C/c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1 409005728 KHYVDTNUMNBALF-HYARGMPZSA-N 353.397 2.828 50 40 FFGB Cc1ccccc1/C=N/NC(=O)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 1089351 UKMUJXOSRKBALK-UDWIEESQSA-N 363.377 2.912 50 40 FFGB C/C(=N/NC(=O)CSc1nc(C)cc(C)n1)c1ccc([N+](=O)[O-])cc1 15987607 HWYBISIFWCAEND-UNOMPAQXSA-N 359.411 2.634 50 40 FFGB O=C(COc1c(F)cc(Br)cc1F)N/N=C/c1ccco1 4070227 QATNABIXJFVJDZ-UBKPWBPPSA-N 359.126 2.849 50 40 FFGB CCOc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCCl)cc1OC 4380873 BACKOFJENFODPY-HNNXBMFYSA-N 368.817 2.504 50 40 FFGB Cc1ccc(OCC(=O)NNC(=O)COc2ccc3ccccc3c2)cc1 4713813 NKZPAGRFTJIYPY-UHFFFAOYSA-N 364.401 2.753 50 40 FFGB CCOC(=O)N/N=C(\C)c1ccc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 101642683 OATKSAVZVHIREP-ZAYKHXHNSA-N 357.410 2.836 50 40 FFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2ccc(O)cc2)CC1 409005698 JWOUEXFMPLNZIQ-HYARGMPZSA-N 365.433 2.703 50 40 FFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cccc(OC)c1 408907401 NETPCMYLYHWIPC-ALDSOSFCSA-N 369.421 2.503 50 40 FFGB COc1cccc(/C=N/NC(=O)c2c(C)nc3ccc(Cl)cn23)c1O 4094636 MTGFVRLOUBGPDL-UFWORHAWSA-N 358.785 2.774 50 40 FFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)NN=C1CCCC1 19947733 AHDPUXTYISULLY-UHFFFAOYSA-N 371.462 2.928 50 40 FFGB O=S1(=O)CCc2ccccc2[C@H](Br)[C@H]1Br 1653740 CBWQIAZOKMCABI-UWVGGRQHSA-N 354.063 2.815 50 40 FFGB COc1cccc(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)c1 8733193 ZHSWCFXLSOPZBD-AWEZNQCLSA-N 371.275 2.950 50 40 FFGB CC[C@@H](C)NC(=O)/C(C#N)=C/c1cc(Br)cc(OC)c1O 408812234 OAJFNXYFBPJWIZ-JTTRITNRSA-N 353.216 2.985 50 40 FFGB Cc1cccc(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)c1C 8474885 VEPIMNVKKALHAX-XYVIHTCUSA-N 364.239 2.813 50 40 FFGB CS(=O)(=O)N1CCC(C(=O)NN(c2ccccc2)c2ccccc2)CC1 15518954 DPEZALUUNUCQHW-UHFFFAOYSA-N 373.478 2.528 50 40 FFGB COc1ccccc1C(=O)N/N=C(\C)CC(=O)NCc1ccc(F)cc1 5289466 KEAPFOBUTAIIMQ-LPYMAVHISA-N 357.385 2.647 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccco3)s2)cc1 12985337 HJWGZIGRXAKWLC-UHFFFAOYSA-N 369.402 2.977 50 40 FFGB O=C(NNc1ccc(F)cc1)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 40069338 UMWSAYNQNOFLBR-HNNXBMFYSA-N 353.397 2.811 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)c3ccc(O)c(Cl)c3)ccc21 12537296 DAKPOQXDFGJIHV-UHFFFAOYSA-N 372.812 2.798 50 40 FFGB O=C(CCC(=O)Nc1ccccc1)NNC(=S)Nc1ccc(F)cc1 1894978 CQAUCAOPWOMLOY-UHFFFAOYSA-N 360.414 2.562 50 40 FFGB C[C@@H](Sc1nc2ccccc2s1)C(=O)NNC(=O)c1ccccc1O 95447645 PVKTZQRYVFNVCG-SNVBAGLBSA-N 373.459 2.944 50 40 FFGB COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)C(C)(C)C)cc1 298787738 CJMUHQJLHLLWDZ-UHFFFAOYSA-N 369.421 2.755 50 40 FFGB Cc1ccc(SCC(=O)NNC(=O)c2cc3ccccc3oc2=O)cc1 12976623 JDVSUDDXPRKZJA-UHFFFAOYSA-N 368.414 2.655 50 40 FFGB O=C(NNC(=O)C1(c2ccccc2)CCC1)c1cc(Br)c[nH]1 26218115 XFSLSOCJRTXVKN-UHFFFAOYSA-N 362.227 2.660 50 40 FFGB CCOC(=O)C1=C(c2cccs2)OC(N)=C(C#N)[C@H]1c1cccnc1 2358746 XRSWYJFUYNRFOP-CQSZACIVSA-N 353.403 2.925 50 40 FFGB Cc1cc(Cl)ccc1O[C@H](C)C(=O)N/N=C1/C(=O)Nc2ccccc21 6130642 KLFBOLKFZSHOME-LLVKDONJSA-N 357.797 2.888 50 40 FFGB COc1ccc(SCC(=O)N/N=C/c2cc3c(cc2OC)OCO3)cc1 409107689 SMKURZYTEWPBAO-DJKKODMXSA-N 374.418 2.675 50 40 FFGB COc1cc(OC)c(/C=N/NC(=O)c2ccco2)cc1Br 408718894 UIEMCTSQJWHZNH-LZYBPNLTSA-N 353.172 2.823 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1ccccc1Br 15873241 HPNACSQNIKTLRR-UHFFFAOYSA-N 364.268 2.758 50 40 FFGB C/C(CC(=O)Nc1ccc(F)cc1F)=N\NC(=O)COc1ccccc1 101546954 STYVIVNAOIPIPW-WSDLNYQXSA-N 361.348 2.865 50 40 FFGB CCOc1ccc(C(=O)N/N=C(/C)C2C(=O)c3ccccc3C2=O)cc1 100004570 RVOHQPZSPNFXSB-MTJSOVHGSA-N 350.374 2.886 50 40 FFGB COc1cc(/C=N/NC(=O)c2cn(C)c3ccccc23)cc(OC)c1OC 1248738 MSLFDDZDRLVNIB-SRZZPIQSSA-N 367.405 2.968 50 40 FFGB CCOc1cc2c(cc1/C=C/C(=O)NNC(=O)c1ccoc1C)O[C@H](C)C2 70019278 YGVHEGAVAGLIGB-BTDICHCPSA-N 370.405 2.785 50 40 FFGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=CCC[C@@H]2[C@H]1c1ccc(OC)cc1 254841400 RJCZKWNAUSKZQS-CDXJDZJCSA-N 363.417 2.938 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCC1)c1ccc(Cl)cc1 19954258 XURRXBPCNFVUCD-UHFFFAOYSA-N 357.863 2.542 50 40 FFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)c(OC)c1OC 85409031 XWVURMSTWFAOJY-MRXNPFEDSA-N 354.362 2.636 50 40 FFGB O=C(Cc1ccccc1)NC(NC(=O)Cc1ccccc1)C(Cl)Cl 3137460 VKDSFBATRBKIIM-UHFFFAOYSA-N 365.260 2.834 50 40 FFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3cccc(OC)c3O)ccc21 3251446 KQRYDAZAERMRAY-RGVLZGJSSA-N 352.394 2.843 50 40 FFGB CCOc1cc([N+](=O)[O-])cc(/C=N/NC(=O)CNc2ccc(C)cc2)c1O 36145054 XMGBLYGHXDNQQN-KEBDBYFISA-N 372.381 2.570 50 40 FFGB COc1ccc2ccccc2c1/C=N/NC(=O)C(=O)N1CCCCCC1 4508939 YGDDGQLVKUHPRI-KGENOOAVSA-N 353.422 2.701 50 40 FFGB CCOC(=O)COc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2)cc1 409363479 UAKHVFGSNDWIMY-BKUYFWCQSA-N 354.406 2.630 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1Br)c1ccccc1O 408592415 YBAPALHXLZHLOX-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CCOc1cc([N+](=O)[O-])cc(/C=C(/C#N)C(=O)NCc2ccco2)c1O 72336327 KUFFATMJXLEMAK-SDQBBNPISA-N 357.322 2.515 50 40 FFGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)OCC(=O)NCC1CCCCC1 3220985 WAEZIXIEGBZYOP-PXNMLYILSA-N 370.405 2.562 50 40 FFGB CC(C)c1ccc(N(CC(=O)NN=C2CCCC2)S(C)(=O)=O)cc1 408787330 XXRWFXFWCUGZMC-UHFFFAOYSA-N 351.472 2.622 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)c([N+](=O)[O-])cc1OC 408979560 RNGLYJDGEANRLA-AWNIVKPZSA-N 356.338 2.673 50 40 FFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1cc(-c2ccco2)on1 36806509 OGMLORCNESPMDH-UHFFFAOYSA-N 355.394 2.912 50 40 FFGB CC(C)(C)OC(=O)COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 636718 JSTUIBDDAUCJOS-CIAFOILYSA-N 370.405 2.877 50 40 FFGB Cc1cccc(NC(=S)NNC(=O)Cc2nc3ccccc3n2C)c1C 5266981 FUQGWIJNKIUNEX-UHFFFAOYSA-N 367.478 2.750 50 40 FFGB COc1c(C/C(C)=N/NC(=O)c2cccs2)cc2c(c1OC)OCO2 15084119 NNEOGKVYQCPCIG-VCHYOVAHSA-N 362.407 2.842 50 40 FFGB CCCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(Cl)cc2)c1 408608683 IEOVSNGDKZSHST-WSDLNYQXSA-N 373.840 2.895 50 40 FFGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 226368083 ZWQLRSMNSAZTQX-UHFFFAOYSA-N 372.768 2.803 50 40 FFGB CC(=O)Nc1ccc(S(=O)(=O)c2ccc(NC(=O)CCl)cc2)cc1 1843204 WFFQMXPDDLAINE-UHFFFAOYSA-N 366.826 2.655 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2cccs2)cc1Br 6595871 OGYBQDVUTHFJCU-UHFFFAOYSA-N 369.240 2.984 50 40 FFGB CN(C)c1ccc(/C=N/NC(=O)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 8780160 CVNBZXDYSXHFCK-KEBDBYFISA-N 351.366 2.906 50 40 FFGB COc1cc(/C=N/NC(=O)COc2ccccc2C)cc(OC)c1OC 3087591 TUQQGPMCQJWPMK-RGVLZGJSSA-N 358.394 2.550 50 40 FFGB O=C(NNc1ncccn1)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1 45075898 CREFAWXIEKMWAF-SFHVURJKSA-N 358.405 2.927 50 40 FFGB O=C(N/N=C/c1cccc(OCc2ccccc2)c1)C(=O)N1CCCCC1 409004032 AADVYNROKQQEOV-PXLXIMEGSA-N 365.433 2.728 50 40 FFGB Cc1ccc(SCC(=O)N/N=C/c2ccn(CC(F)(F)F)n2)cc1 252484203 FRHZOJSMPBTFEK-UFWORHAWSA-N 356.373 2.996 50 40 FFGB CCO/C=N/C1=C(C#N)SC2=N/C(=C/c3ccc(OC)cc3)C(=O)N21 1649842 QWXSUNLIDKDWMQ-MGXGLFJDSA-N 354.391 2.739 50 40 FFGB Nc1ccccc1C(=O)N/N=C/c1ccc(I)cc1 6971584 BFCJRQCSWWVMFB-RQZCQDPDSA-N 365.174 2.637 50 40 FFGB COc1c(Br)cc(/C=N/NC(C)=O)cc1Br 59426202 VIXIFOLHGJZOQG-WLRTZDKTSA-N 350.010 2.690 50 40 FFGB Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)c3ccccc3F)c12 48253640 KDVUQZRVVYLKJA-UHFFFAOYSA-N 354.341 2.623 50 40 FFGB O=C(NNC(=O)c1ccccc1C(=O)c1ccc(F)cc1)c1cccnc1 12890751 ZJDZQKSRPOICLN-UHFFFAOYSA-N 363.348 2.527 50 40 FFGB N#C/C(=C\c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1)C(N)=O 408764957 ODVRHEXSVRSGAC-UKTHLTGXSA-N 355.781 2.750 50 40 FFGB Cc1ccc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)cc1 20207898 KFNBTMKXLWVCHD-UHFFFAOYSA-N 351.472 2.587 50 40 FFGB O=C(O)COc1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1 408962315 HDURRHLFNWDDIW-ZVBGSRNCSA-N 366.295 2.933 50 40 FFGB Cc1cc(OCC(=O)N/N=C/c2cc(O)ccc2[N+](=O)[O-])ccc1Cl 35655046 SEMICHWJBAAXIV-QGMBQPNBSA-N 363.757 2.791 50 40 FFGB O=C(CSc1ncccn1)N/N=C/c1cn(-c2ccccc2)nc1Cl 80324536 GRKGTFFAHMKASU-AWQFTUOYSA-N 372.841 2.558 50 40 FFGB O=S1(=O)C[C@H](Cl)[C@H](OC(Cl)(Cl)C(Cl)(Cl)Cl)C1 12175831 BADYEMQWKWXDSG-IUYQGCFVSA-N 370.896 2.909 50 40 FFGB COc1ccc([C@H]2[C@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3I)cc1 104120279 KJZGQLKFWYXPAD-WCQYUDONSA-N 370.186 2.774 50 40 FFGB NNC(=O)c1ccc([C@@H]2c3sc(=O)[nH]c3S[C@@H]3[C@@H]4CC[C@H](C4)[C@H]23)cc1 100972081 KJTWZWQRLVXAGM-RKQHYHRCSA-N 373.503 2.692 50 40 FFGB COc1ccc(/C=C/C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1 1781553 ZRAFDTIJMZCOKJ-YRNVUSSQSA-N 354.406 2.552 50 40 FFGB Cc1ccc(NC(=S)NNC(=O)c2nnn(-c3ccccc3)c2C)cc1 8685004 BJDDYHRVCAUSQV-UHFFFAOYSA-N 366.450 2.516 50 40 FFGB CCn1c(NNC(=O)[C@H](C)Oc2ccc(C)cc2)nc2ccccc2c1=O 10680862 YYGCLHBVNUGXOW-AWEZNQCLSA-N 366.421 2.635 50 40 FFGB O=C(N/N=C/c1ccc(OCc2ccccc2Cl)cc1)C(=O)NC1CC1 4575853 GBOUDLVKCKYYTG-SRZZPIQSSA-N 371.824 2.648 50 40 FFGB Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 3168929 YZKLFQMWNCLKPL-GIJQJNRQSA-N 360.757 2.645 50 40 FFGB CCO[C@@]1(c2ccccc2)C[C@@H]1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 4935949 SDYRFMRPNJOSNS-FLWYYKORSA-N 353.378 2.997 50 40 FFGB N#CC1=C(S)N(c2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC1=O 9089675 JRAHJOUJFQVGQC-HNNXBMFYSA-N 352.375 2.895 50 40 FFGB Cc1cc(C)c(NCC(=O)NNC(=O)CCC(=O)c2cccs2)c(C)c1 9314638 JSLLCLFKTKIWGT-UHFFFAOYSA-N 373.478 2.896 50 40 FFGB O=C(CCl)N(c1c(Cl)cccc1Cl)[C@H]1CCS(=O)(=O)C1 217380169 LLRKKPDSSXZRLS-QMMMGPOBSA-N 356.658 2.752 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccccc3Cl)CC2=O)cc1 96941882 DSNUUKPVZOWRQM-LRXPYSHVSA-N 371.824 2.852 50 40 FFGB COC(=O)N/N=C(/c1ccccc1)c1c(C)nn(-c2ccccc2)c1O 16249353 FGZIZKHRQIIPGM-JZJYNLBNSA-N 350.378 2.995 50 40 FFGB Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1NC(=O)c1ccccc1 6825549 UYMLLXAJYWGAPD-LPYMAVHISA-N 361.405 2.648 50 40 FFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc(Br)ccc1F 664347 UVUODLYOTWSZBX-CYBMUJFWSA-N 367.174 2.843 50 40 FFGB Cc1ccc(/C=N\NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)o1 19850010 CAMBTQDLUYYRFB-MTJSOVHGSA-N 374.872 2.509 50 40 FFGB Cc1ccccc1CSCC(=O)N/N=C1/C(=O)N(C)c2ccccc21 409328388 UEBPXIRZOZIWIT-DYTRJAOYSA-N 353.447 2.725 50 40 FFGB O=C(NNc1ccccc1[N+](=O)[O-])c1ccc(OC[C@H]2CCCO2)cc1 33026404 QNURQCUONHCDOV-OAHLLOKOSA-N 357.366 2.910 50 40 FFGB C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N[C@@H]1SC(=O)[C@H]1CCCO1 196025110 CYIYODQQOPTSEF-NRWUCQMLSA-N 359.564 2.908 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)COc2ccc(C#N)cc2)cc1 3308305 GHPLBSSOFJDJAW-HYARGMPZSA-N 350.422 2.934 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCC3)c2C)cc1C 408995157 AFKXIMCRAQQVJG-LPYMAVHISA-N 366.465 2.783 50 40 FFGB O=C(NNC(=O)[C@H]1Cc2ccccc2S1)[C@@H]1Cc2ccccc2S1 40158825 MZPFEIFWEXCNNX-IYBDPMFKSA-N 356.472 2.568 50 40 FFGB CCOc1c(/C=N/NC(=O)c2cc(OC)cc(OC)c2)cccc1OC 6892257 BTWWIFRHHLSLFU-UDWIEESQSA-N 358.394 2.875 50 40 FFGB COc1cccc(NCC(=O)NNC(=O)c2csc3c2CC[C@@H](C)C3)c1 8707298 IORTYXHWQDVUGI-GFCCVEGCSA-N 373.478 2.755 50 40 FFGB O=C(NN=C1CCN(c2ccc(F)cc2)CC1)[C@H]1COc2ccccc2O1 84583068 SYUHIHFSWSWVOP-LJQANCHMSA-N 369.396 2.738 50 40 FFGB CC(=O)Oc1ccc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1 408756566 WECUVFAHARHAOB-VXLYETTFSA-N 368.418 2.731 50 40 FFGB CCc1ccc(OCC(=O)n2c(C)c(C(=O)NN)c3ccccc32)cc1 216723213 AXNAXYHTPIKXQL-UHFFFAOYSA-N 351.406 2.835 50 40 FFGB COC(=O)[C@@H](CNC(=O)[C@H](C)Br)Cc1ccc(Cl)cc1 95097985 AVRVVAQZADXCHM-GXSJLCMTSA-N 362.651 2.571 50 40 FFGB CC(C)c1ccc(C(=O)N/N=N\Nc2ccc(S(N)(=O)=O)cc2)cc1 17355186 MIJGCTWGLWEZNR-UHFFFAOYSA-N 361.427 2.582 50 40 FFGB Cn1c(CC(=O)NNC(=O)Nc2ccc(Cl)cc2)nc2ccccc21 6550055 UKHKQCKBECMRLX-UHFFFAOYSA-N 357.801 2.622 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)CCOc2ccccc2C)cc1 8350626 LSJFJTXTQXWGBS-UHFFFAOYSA-N 356.422 2.553 50 40 FFGB C/C(CC(=O)NC12CC3CC(CC(C3)C1)C2)=N\NC(=O)c1cccnc1 100089596 NSJIOIJIANWZQN-YDZHTSKRSA-N 354.454 2.662 50 40 FFGB CCOC(=O)CCn1cc(/C=C(\C#N)C(N)=S)c(-c2ccccc2)n1 3215404 MGCLLZBWTQMPMD-GXDHUFHOSA-N 354.435 2.696 50 40 FFGB C#CCOc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OC 2163683 IHMSYEYSDGOVPA-SFHVURJKSA-N 350.374 2.522 50 40 FFGB Cc1cccc(N(NC(=O)C(=O)n2ccc3ccccc32)C(=O)CCl)c1 2237452 GWGZXEWAODBPTL-UHFFFAOYSA-N 369.808 2.893 50 40 FFGB COCC1=C(C(=O)OC)[C@H](c2ccccc2C(F)(F)F)C(C#N)=C(N)O1 4189177 HNZXSPXHHMADRV-CYBMUJFWSA-N 368.311 2.587 50 40 FFGB Cc1nn(-c2ccc(C(=O)NNC(=O)c3ccco3)cc2)c(C)c1Cl 17256363 VNURJLYXUGSBJS-UHFFFAOYSA-N 358.785 2.810 50 40 FFGB O=C(/C=C/c1ccc(-c2ccccc2F)o1)NNC(=O)NC[C@H]1CCCO1 68447851 DOYYAVSTBCWKTN-QSYFUGGGSA-N 373.384 2.608 50 40 FFGB COc1ccc(-c2nc(C)c(C(=O)NNC(=O)c3ccco3)s2)cc1 9503390 PUGZIZYLQAVTRX-UHFFFAOYSA-N 357.391 2.795 50 40 FFGB CC(C)=C1[C@H]2CC[C@@H]1[C@H](C(=O)NNC(=O)c1sccc1C)[C@H]2C(=O)O 5756413 FCUZTBBHXJMZQL-XCCSTKFXSA-N 362.451 2.511 50 40 FFGB Cc1cc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)c2ccccc2n1 2320633 WEBOWIQQSVLNMU-VXLYETTFSA-N 350.334 2.921 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC(C)(C)C)c(C)n1-c1ccc(F)cc1 408973580 UMSZOPPXAFAYAC-SRZZPIQSSA-N 358.417 2.598 50 40 FFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(Br)o2)cc1 5378363 FJGRZGDBLAURLF-LZYBPNLTSA-N 350.172 2.764 50 40 FFGB C[C@H](C(=O)N/N=C/c1cccc(Br)c1)n1nnc2ccccc21 994077 JXQTZJMGNXQKIJ-VDCVXVNISA-N 372.226 2.905 50 40 FFGB COCCn1cc(C(=O)NNc2ccccc2[N+](=O)[O-])c2ccccc21 57419842 KNJFDYPJOGEYQY-UHFFFAOYSA-N 354.366 2.953 50 40 FFGB N#C/C(=C\c1c(Oc2ccccc2Cl)nc2ccccn2c1=O)C(N)=O 4205431 YOVLCVYJEOXQNK-PKNBQFBNSA-N 366.764 2.532 50 40 FFGB Cc1ccc(OCC(=O)N/N=C\c2c[nH]c3ccccc23)c([N+](=O)[O-])c1 13893872 DSBPRQYPHHLMMI-JMIUGGIZSA-N 352.350 2.914 50 40 FFGB C/C(=N/NC(=O)c1ccccn1)c1cccc(NC(=O)C(F)(F)F)c1 5888662 UYQPLVFCYKKFQU-YVNNLAQVSA-N 350.300 2.736 50 40 FFGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)c1cccc(Br)c1 36186164 XUGFAZUIZYCSJD-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CCn1ncc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)c1C(F)(F)F 253400558 LJHJPKMBZUWVRK-LBPRGKRZSA-N 352.316 2.737 50 40 FFGB O=C(c1ccc(N2CCOCC2)cc1)C(Br)Br 100179764 QXPUJNSXXOICAH-UHFFFAOYSA-N 363.049 2.822 50 40 FFGB O=C(CCc1ccccc1)NNC(=S)NC(=O)c1ccc(Cl)cc1 2135543 UWVBEALNNHEDTM-UHFFFAOYSA-N 361.854 2.608 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1 14134469 RBZYVYBCKNCWDA-RGVLZGJSSA-N 360.797 2.585 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(C)c([N+](=O)[O-])c2)n1 5547379 XSUGPBNAQMAECL-CAOOACKPSA-N 359.411 2.552 50 40 FFGB NNC(=O)c1cn(C(=O)c2ccc(Br)cc2)c2ccccc12 226366593 XXLHJCNJYOUCMI-UHFFFAOYSA-N 358.195 2.696 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)ccc1OC(F)F 6684251 CVFDCRXZUPDOCS-DNTJNYDQSA-N 364.304 2.789 50 40 FFGB CN(C)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1 7496493 POGFSHSUZJJJRN-QGZVFWFLSA-N 358.401 2.812 50 40 FFGB CCCOc1ccc(C(=O)NNC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 21896924 QPUPSOGFIZQNQO-UHFFFAOYSA-N 357.366 2.767 50 40 FFGB O=C(Cc1ccccc1)N/N=C/c1ccc(N2CCCC2)c([N+](=O)[O-])c1 4054221 WEKALHCZPQBHCM-XSFVSMFZSA-N 352.394 2.888 50 40 FFGB CCCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccccc2C(=O)O)C1=O 5021822 RSEOLQBUCMZSJN-PTNGSMBKSA-N 353.378 2.690 50 40 FFGB O=C(N/N=C1\CCSc2ccc(F)cc21)[C@H]1COc2ccccc2O1 5164164 TWXRPCRUEICZNH-RBYWHNRPSA-N 358.394 2.982 50 40 FFGB Cc1cccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 408996269 CTFRZAHLADJUOB-DEDYPNTBSA-N 368.393 2.504 50 40 FFGB CCOC(=O)CCC(=O)NNC(=O)c1sc2ccccc2c1Cl 4525213 FNMRHLAPQJFZBY-UHFFFAOYSA-N 354.815 2.659 50 40 FFGB CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)cc1OCC 5408583 GXOBSDDRXLXGDG-MRXNPFEDSA-N 370.409 2.572 50 40 FFGB CCOC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 14795058 QKEJVLLCKBOHCQ-UHFFFAOYSA-N 350.378 2.930 50 40 FFGB CCOC(=O)c1ccc(=O)n(Cc2ccccc2)c1CBr 218311574 GNJHAOVOKIXGFN-UHFFFAOYSA-N 350.212 2.968 50 40 FFGB COc1cccc(C(=O)N/N=C/c2ccc(OCC(=O)OC(C)C)cc2)c1 6327976 LUROLDFASYQDNN-CIAFOILYSA-N 370.405 2.790 50 40 FFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2cccs2)c(OC)c1 100522956 DPCRYCQBCBKJET-YBFXNURJSA-N 361.423 2.900 50 40 FFGB O=C(/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)NNC(=O)c1cccs1 7781391 FITVCCDBWKTRGG-GQCTYLIASA-N 351.771 2.784 50 40 FFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccc(Br)o1 3073365 XLYFZFUXIGROSQ-LBPRGKRZSA-N 353.172 2.687 50 40 FFGB COC(=O)c1sccc1NC(=O)/C(C#N)=C/c1c[nH]c2ncccc12 49550370 JFQVHNWPNCMKJA-JXMROGBWSA-N 352.375 2.957 50 40 FFGB C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1 97664035 FLVIPETUBIXORZ-LQXHQAILSA-N 369.465 2.992 50 40 FFGB O=C(N/N=C/c1ccccn1)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 409004919 GEGHSFAREVFVDH-LPYMAVHISA-N 370.840 2.738 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)c(O)c1 5585310 RJUGXTZELHCOKM-FYJGNVAPSA-N 368.437 2.961 50 40 FFGB Cc1cc2ccccc2n1CC(=O)NNC(=S)NCc1ccccc1 29636520 ZYRIAHWRKSDRFN-UHFFFAOYSA-N 352.463 2.645 50 40 FFGB Cc1ccc(C(=O)N/N=C2/C(=O)N(C)c3ccc(Br)cc32)cc1 2743317 JRNLBIUVMSVCAC-XDJHFCHBSA-N 372.222 2.868 50 40 FFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc(F)cc3)CC2=O)cc1 725269 OUIKQSWAVQBGJY-BFTVFPACSA-N 353.397 2.891 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NCC(C)C)c(C)n1-c1ccccc1Cl 58903915 VEZDIIYGURMKIQ-SSDVNMTOSA-N 374.872 2.970 50 40 FFGB COC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)N(C)C)cc1Cl 59334134 TYRWOCPHUOFTKN-WMZJFQQLSA-N 357.193 2.540 50 40 FFGB CN1/C(=C(/C#N)c2nc(C#N)c(C#N)nc2N2CCCC2)Nc2ccccc21 1748308 GLKMSBPHPWYYHP-UYRXBGFRSA-N 368.404 2.574 50 40 FFGB C/C(=N\NC(=O)c1ccncc1)c1cccc(I)c1 408771689 AQWIIKBJKVTMLM-LICLKQGHSA-N 365.174 2.840 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1 12984684 JBQWBODLJJICEP-UHFFFAOYSA-N 364.492 2.949 50 40 FFGB CCOc1ccc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1OCC 409045769 HWZNZFPFCMAQNT-CIAFOILYSA-N 370.405 2.906 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1Nc1ccc(C)cc1 408709342 ZYDRSJCVZSKDGG-SRZZPIQSSA-N 358.829 2.978 50 40 FFGB COc1ccc(C)c2sc(NNC(=O)[C@@H]3COc4ccccc4O3)nc12 4121473 WVBJBLNEILDASS-AWEZNQCLSA-N 371.418 2.896 50 40 FFGB O=C(N/N=C\c1cc(Cl)cc(Cl)c1O)[C@@H]1COc2ccccc2O1 13583924 IRXLKBDYWFIHOB-FDFSMXBESA-N 367.188 2.989 50 40 FFGB C[C@@H]1Oc2ccccc2C=C1/C=N/NC(=O)CCNC(=O)OC(C)(C)C 5047122 ODOQJFMAJXUFNA-XMOVILSBSA-N 359.426 2.868 50 40 FFGB N#C/C(=C/c1cc([N+](=O)[O-])ccc1O)C(=O)NCCCc1ccccc1 409239319 MSHQFXBDSBKBJO-WJDWOHSUSA-N 351.362 2.956 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@@H]12)N/N=C1/C[C@H]2C=CC[C@@H]12 225691296 GIRIUIXSQOYDQJ-QNHLTZERSA-N 354.454 2.683 50 40 FFGB COc1cccc(NC(=O)/C(C#N)=C\c2cc(OC)c(O)c(OC)c2)c1 6373226 WAFWAEKLNWGXCN-QPEQYQDCSA-N 354.362 2.964 50 40 FFGB O=C(N/N=C/c1cccs1)c1ccc(C(=O)N/N=C/c2cccs2)o1 2779718 SIXSZWRIHKKKNQ-BEQMOXJMSA-N 372.431 2.930 50 40 FFGB CC(=O)NNC(=O)CSc1nc(C)c(C)n1[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 107329188 PFXSEEHHDLLQOM-SYAUCNOPSA-N 364.515 2.757 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2n[nH]c3ccccc23)c1 27620280 NWSRNNGLNLGMIY-UHFFFAOYSA-N 366.421 2.835 50 40 FFGB Cc1ccc(CC(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1C 408566389 GBGCQAXLTZVEPL-DJKKODMXSA-N 355.350 2.633 50 40 FFGB Cc1c(NC(=O)/C(C#N)=C/c2ccc(O)cc2)c(=O)n(-c2ccccc2)n1C 1452701 CCPXARZAKKLKAX-FOWTUZBSSA-N 374.400 2.736 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2cccc(I)c2)o1 819747 GZTSVUKKCKYMGJ-OVCLIPMQSA-N 354.147 2.957 50 40 FFGB COc1cccc(/C=N/NC(=O)COc2ccccc2Br)c1 994110 ALASTSWRAPBAFK-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB COc1ccc(/C=N/NC(=O)CCC(=O)Nc2ccc(F)cc2)cc1OC 1959918 LSUNRUZAGANLSB-CIAFOILYSA-N 373.384 2.712 50 40 FFGB biogenic Cc1ccc(/C=C/C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl 12781561 PEBPGAKCMWWTCM-KBOKABMXSA-N 372.808 2.649 50 40 FFGB O=C(N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21)c1ccccn1 18106177 WUOLLMRVYGQVKN-NMWGTECJSA-N 356.385 2.763 50 40 FFGB Cc1ccc(-c2cc3c(=O)n(Cc4noc(CCl)n4)ccn3n2)cc1C 98212169 FMGLQQOBTGMRFR-UHFFFAOYSA-N 369.812 2.950 50 40 FFGB C/C(=N\NC(=O)c1cccnc1)c1cccc(I)c1 408772476 POMHOCVBNWBYCP-LICLKQGHSA-N 365.174 2.840 50 40 FFGB C=CCOc1ccc([C@@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1OC 409132213 LTOCGNNZUIJDQV-LJQANCHMSA-N 365.433 2.990 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1C)S(C)(=O)=O)C(C)(C)C 408774327 ZKXFDDZAHIKAAI-LDADJPATSA-N 373.906 2.953 50 40 FFGB CCc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 8083983 XGLYLWXJHDZYSZ-BFTVFPACSA-N 353.397 2.891 50 40 FFGB O=C1N(CCBr)c2c(ccc(Cl)c2Cl)C12OCCO2 8047287 SOKUUZOMXMIMAM-UHFFFAOYSA-N 367.026 2.935 50 40 FFGB N#CC1=C(N)SC(N)=C(C#N)C1c1ccc(Br)cc1F 2361776 OOYRMYSHRKAUQR-UHFFFAOYSA-N 351.204 2.806 50 40 FFGB O=C(CCCC(=O)N/N=C/c1ccc(F)cc1)N/N=C/c1ccc(F)cc1 2362341 XGLMBDGHMWBHMF-FWSOMWAYSA-N 372.375 2.736 50 40 FFGB Cc1cc(F)ccc1S(=O)(=O)NNC(=O)c1oc2ccccc2c1C 22842443 GJPKJRXUCYKKNK-UHFFFAOYSA-N 362.382 2.812 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc[nH]n2)cc1COc1ccc(F)cc1 13108473 JAVKUOCLMUVLOV-SSDVNMTOSA-N 368.368 2.900 50 40 FFGB CCOc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)ccc1OCC(N)=O 13880141 QQRQOEVYNQPGOQ-NTEUORMPSA-N 362.389 2.890 50 40 FFGB CN1C(=O)/C(=C/NNC(=O)c2cc3ccccc3cc2O)c2ccccc21 95351651 DIRKITSBUGFFBM-SFQUDFHCSA-N 359.385 2.797 50 40 FFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@@H](c1ccccc1)C(C#N)=C(N)O2 1471753 ASBNKXCCEQIFJV-IBGZPJMESA-N 370.412 2.818 50 40 FFGB C#CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1 69001501 FMSDQAXKCSWIOY-JZJYNLBNSA-N 371.440 2.954 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1c1ccc(C(=O)O)cc1 18199669 QTGHPOZDYAZAMH-OAHLLOKOSA-N 360.325 2.709 50 40 FFGB O=C(COc1cc(Cl)ccc1Cl)NNC(=O)c1cccc(O)c1 8745212 DAMJVHYCLJFDOY-UHFFFAOYSA-N 355.177 2.539 50 40 FFGB COCc1cccc(C(=O)NNC(=O)c2ccccc2Br)c1 7913472 YKFMPDHJCOZAFL-UHFFFAOYSA-N 363.211 2.670 50 40 FFGB N#CCOc1ccccc1/C=N\NC(=O)COc1cccc2cccnc12 409022413 NQTPVJHYTVEHGW-QRVIBDJDSA-N 360.373 2.666 50 40 FFGB O=C(CNC1CCCCC1)N/N=C/c1cc(Br)ccc1O 409388241 SYRZTSTXTUGCOS-GIJQJNRQSA-N 354.248 2.527 50 40 FFGB COc1ccc(O)c(/C=N/NC(=O)c2cc(Br)ccc2O)c1 3122938 PNJVVMXXUDHACX-CAOOACKPSA-N 365.183 2.633 50 40 FFGB CCOC(=O)NNC(=O)c1cc(-c2ccccc2F)nc2onc(C)c12 40024961 WXUHMOZHAQLBJE-UHFFFAOYSA-N 358.329 2.728 50 40 FFGB Cc1ncc[nH]/c1=N/N=C\c1ccc(N(CCCl)CCCl)cc1 4824315 BZUKWQAECDBYJZ-MTJSOVHGSA-N 352.269 2.937 50 40 FFGB CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)oc(=O)c32)cc1OC 4476329 BERBUCYSRUDUFN-KRWDZBQOSA-N 368.389 2.964 50 40 FFGB C/C(Cc1ccccc1)=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4695802 UKIDHDCJAXWPGZ-LDADJPATSA-N 356.338 2.780 50 40 FFGB Cc1cccc(C)c1N(CC(=O)NN=C1CCCCC1)S(C)(=O)=O 19955402 CYIZNMQXXMNBEH-UHFFFAOYSA-N 351.472 2.506 50 40 FFGB Cc1ncc(C(=O)N/N=C/c2ccc3c(c2)OCC(C)(C)CO3)c(C)n1 225370770 MDSDTPFQIYPLOJ-ODCIPOBUSA-N 354.410 2.655 50 40 FFGB O=C(N/N=C/c1ccn(CC(F)(F)F)n1)c1cc(-c2cccs2)on1 252498578 RFFNZFXSGDKQSQ-CNHKJKLMSA-N 369.328 2.926 50 40 FFGB CC1(C)[C@@]2(CBr)CC[C@@]1(C(=O)O)[C@H](Br)C2=O 100745947 MFQZVXXGEBQQQI-PFZYVWIYSA-N 354.038 2.605 50 40 FFGB CCCCNC(=O)CSC1=C(C#N)[C@@H](c2ccc(C)cc2)CC(=O)N1 6323099 RVMQLISEPZHRRO-OAHLLOKOSA-N 357.479 2.983 50 40 FFGB CCOc1c(Cl)cc(C(=O)NNC(=O)c2ccccc2O)cc1OC 12870084 JLQVYYJSLDWYFP-UHFFFAOYSA-N 364.785 2.528 50 40 FFGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)Nc1ccc(O)cc1 409369998 IZPPNACVEFKJLZ-VZUCSPMQSA-N 353.290 2.575 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)c(OC)c1 409045075 YCKRUHJLDWIARF-XDHOZWIPSA-N 357.366 2.695 50 40 FFGB C/C(N)=C(/C#N)C(=O)COC(=O)c1ccccc1C(=O)c1ccc(C)cc1 13685059 IQTQJTWEWSRZRC-NBVRZTHBSA-N 362.385 2.708 50 40 FFGB CN1/C(=C(\C#N)C(=O)CN2CCN(c3ccccc3)CC2)Nc2ccccc21 102445220 PFMUWZFKXVCSHH-RELWKKBWSA-N 373.460 2.675 50 40 FFGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1ccc2c(c1)OCCO2 408718154 MPROAYDFJFMPNG-AWQFTUOYSA-N 370.796 2.831 50 40 FFGB COc1cc(/C=N\NC(=O)COc2cccc(C)c2C)cc(OC)c1O 30838844 FFYBZXMHXXTVND-JMIUGGIZSA-N 358.394 2.555 50 40 FFGB CC[C@H](Oc1ccc(C)cc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 12137406 SUPVRKRRJYWKNX-INIZCTEOSA-N 357.366 2.522 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(O)c1 3527061 ULYUIEGPHDTVDQ-RGVLZGJSSA-N 355.394 2.731 50 40 FFGB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/NNC(=O)c1ccccc1O 100031711 DWFSQZCJCQMMKG-XNTDXEJSSA-N 370.796 2.587 50 40 FFGB Cc1nc(N)[nH]c(=O)c1CCCNc1ccc(/C=C/C(=O)CCl)cc1 8627122 VOULAGCYJDNJNZ-RMKNXTFCSA-N 360.845 2.526 50 40 FFGB CCn1c(NNC(=O)C2(c3ccccc3)CCC2)nc2ccccc2c1=O 42038377 CWBMYXXSFCBSJO-UHFFFAOYSA-N 362.433 2.981 50 40 FFGB Cc1ccc(OCc2ccc(C(=O)NNC(=O)c3cccnc3)o2)cc1 12894919 AARSZFBXCYYOEP-UHFFFAOYSA-N 351.362 2.637 50 40 FFGB C#CCOc1cccc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)c1 409334481 MCDZCGDKBHOMDX-STZFKDTASA-N 352.390 2.870 50 40 FFGB O=C(COc1ccc2ccccc2c1)NNC(=O)COc1ccccc1F 5273045 OLUBMMRWYBCGPJ-UHFFFAOYSA-N 368.364 2.584 50 40 FFGB Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(O)c(O)c1)C(C#N)=C(N)O2 5537852 CQAIYNXNQYZZTN-SFHVURJKSA-N 360.373 2.810 50 40 FFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)cc1OC 5413430 OSNTZWXDCAQHLR-CIAFOILYSA-N 369.421 2.916 50 40 FFGB NC(=O)N/N=C/c1c(Sc2ccc(Cl)cc2)nc2ccccn2c1=O 26967115 BIKOPEKOOQSZFV-DJKKODMXSA-N 373.825 2.501 50 40 FFGB Cc1cc(C)cc(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)c1 8474874 DRFLLNFZSRTEEU-HGPDSQILSA-N 364.239 2.813 50 40 FFGB CCCC[C@@H](CC)CNC(=O)CCC(=O)NNC(=O)c1cccc(F)c1 4700575 ZJFAZOWUPHHLFL-CQSZACIVSA-N 365.449 2.700 50 40 FFGB CCOc1cc(/C=C/C(=O)NNC(N)=S)ccc1OCc1ccccc1 62715446 PIEWMBVYBURQBS-PKNBQFBNSA-N 371.462 2.542 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccccc2F)c1C 408934949 DRXLGANPHBKTAQ-KIHMUJGBSA-N 358.417 2.598 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=C(\C#N)C(=O)NCc1ccccc1 6180460 HRKCARHNFARYBK-OVCLIPMQSA-N 367.361 2.835 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@H]12)N/N=C1/C[C@H]2C=CC[C@H]12 17073334 GIRIUIXSQOYDQJ-BUYPGRAJSA-N 354.454 2.683 50 40 FFGB CCOc1cc(C(=O)NN)cc(Cl)c1OC(=O)c1ccc(OC)cc1 226307294 OUIKHPPVGUGUIM-UHFFFAOYSA-N 364.785 2.570 50 40 FFGB CC1(C)C(C#N)=C(SCC(=O)N2CCCCCCC2)NC(=O)[C@@H]1C#N 9366497 PFCFPTARAVJMTE-ZDUSSCGKSA-N 360.483 2.543 50 40 FFGB O=C(NN1C(=O)[C@H](Cl)[C@H]1c1ccccc1Cl)c1ccccc1O 1633512 ZOODFJBHTYHNCK-ZIAGYGMSSA-N 351.189 2.881 50 40 FFGB O=C(N/N=C/c1ccsc1)c1ccc(I)c(O)c1 408996531 PVSJFBPSHKTBDI-MKMNVTDBSA-N 372.187 2.822 50 40 FFGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1nnc2n1CCCCC2 8985582 QAGXISVQKLPBRF-WUXMJOGZSA-N 353.338 2.706 50 40 FFGB O=C(CCN(CCCl)CCCl)Nc1ccc2oc(=O)ccc2c1 1698340 UCAIBYOUYPMFJB-UHFFFAOYSA-N 357.237 2.901 50 40 FFGB O=C(COC(=O)c1cccc(Cl)c1)NNC(=O)c1ccc(Cl)cc1 3385622 NJCAMFJADBPSRV-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB O=C(COC(=O)c1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1 3507175 OPWOCVBSBTZQNT-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB OC[C@@H](I)C[C@](F)(OC(F)(F)F)C(F)(F)F 4290063 KPABQJYHRYTITM-IMJSIDKUSA-N 370.002 2.937 50 40 FFGB COc1ccccc1NC(=O)NNC(=O)c1ccc(Br)cc1 2640193 PIPCTAUBKDHYRX-UHFFFAOYSA-N 364.199 2.924 50 40 FFGB Cc1cc(/C=N\NC(=O)CC(=O)NCC(C)C)c(C)n1-c1ccccc1 59960413 WLBCBNPTVNWHON-XKZIYDEJSA-N 354.454 2.707 50 40 FFGB COc1cc2[nH]c(C(=O)N/N=C/c3ccccc3O)cc2c(OC)c1OC 2346960 MYDNWELMEUKHAH-KEBDBYFISA-N 369.377 2.663 50 40 FFGB O=C(NNS(=O)(=O)c1cccc(Cl)c1)c1cc2c(s1)CCCC2 12753526 KUHDRWBZCYVZQM-UHFFFAOYSA-N 370.883 2.904 50 40 FFGB Cc1ccc(OCC(=O)C(C#N)=C2Nc3ccccc3N2)c([N+](=O)[O-])n1 6908769 SEHGUIYHAWZXAD-UHFFFAOYSA-N 351.322 2.519 50 40 FFGB COc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1[N+](=O)[O-] 59401518 MNEFJQQFOZFZNS-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB COc1ccc([C@H]2[C@@H]3C(=C[C@H]4CC[C@H]3N4C)C(C#N)=C(N)C2(C#N)C#N)cc1 103668745 QAWCSHGMVQKVTE-DMSXTEQDSA-N 371.444 2.581 50 40 FFGB COC(=O)c1ccc(COc2ccccc2/C=N/NC(=O)C2CC2)cc1 3276420 FFEACOWTACWVIQ-CIAFOILYSA-N 352.390 2.912 50 40 FFGB C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1OCC 6196140 DNYSVOHRGXPDMN-KRWDZBQOSA-N 352.394 2.900 50 40 FFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1 5163504 HOAGBGHLWIUCQE-HMMYKYKNSA-N 371.462 2.625 50 40 FFGB COc1ccc(/C=N/NC(=O)CNC2CCCCC2)cc1Br 409381118 FGBMZHBWRFTMML-VXLYETTFSA-N 368.275 2.830 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)COc2cccc(C)c2C)c2ccccc21 5557467 CLVMSEYPRNFJTR-ZBJSNUHESA-N 351.406 2.569 50 40 FFGB O=C(NNS(=O)(=O)c1cccc(Cl)c1)c1cc2c(s1)CCC2 7379641 AFKGKISOVOCSLJ-UHFFFAOYSA-N 356.856 2.514 50 40 FFGB C#CCOc1ccc(/C=N\NC(=O)Cc2ccc(F)cc2)cc1OCC 409250938 OXJZXJAAVGZZJH-HMAPJEAMSA-N 354.381 2.929 50 40 FFGB Cc1c(Cl)cccc1N(CC(=O)NN=C1CCCCC1)S(C)(=O)=O 408773090 SPYSZOOLUDGBSL-UHFFFAOYSA-N 371.890 2.851 50 40 FFGB CCn1c(C)c(C(=O)N/N=C/c2ccc(O)cc2O)c2cc(O)ccc21 6395664 NFVWUKITWGXZAB-KEBDBYFISA-N 353.378 2.850 50 40 FFGB O=C(COc1cccc(F)c1)NNC(=O)c1ccc(C(F)(F)F)cc1 3454182 ZMSPAZMDBBVDPN-UHFFFAOYSA-N 356.275 2.685 50 40 FFGB C/C(CC(=O)Nc1ccccc1C#N)=N\NC(=O)c1ccccc1[N+](=O)[O-] 100089779 KBSIQTQPISJXQO-CIAFOILYSA-N 365.349 2.601 50 40 FFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(C(=O)O)cc3)ccc21 3259029 FOUAHLGPSWEUAY-RGVLZGJSSA-N 350.378 2.827 50 40 FFGB CCOc1cc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)ccc1OC 4735451 UWYXBEPNGUIMGA-FYJGNVAPSA-N 372.421 2.804 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)COc2ccccc2C)c2ccccc21 5855724 YCEKBPYTJWSKFK-QOCHGBHMSA-N 351.406 2.651 50 40 FFGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccccc1 7383428 VAYNBKBNXDIBFW-CQSZACIVSA-N 370.430 2.617 50 40 FFGB Cc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(Br)c2)cc1 59515422 LVAODBMMCZARSZ-VCHYOVAHSA-N 360.211 2.846 50 40 FFGB CCN1CCC(=NNC(=O)C(O)(c2ccccc2)c2ccccc2)CC1 55075636 IBHJEASGIVKXNE-UHFFFAOYSA-N 351.450 2.510 50 40 FFGB Cn1cccc1CC(=O)NNC(=O)CC(c1ccccc1)c1ccccc1 3295416 DEIIKFUWFSZAEK-UHFFFAOYSA-N 361.445 2.937 50 40 FFGB CC[C@@H](C)NC(=O)/C(C#N)=C/c1cc(Br)c(O)c(OC)c1 408796519 AKJNQANJZHKWIL-JTTRITNRSA-N 353.216 2.985 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1cc2ccccc2o1 83329051 ZMWAPMHJQTYTGF-IUXPMGMMSA-N 370.277 2.719 50 40 FFGB Cc1ccc2c(c1)S[C@@H](C(=O)NNc1nc(-c3ccncc3)no1)C2 1251577190 ONEUQCFIYHJMLN-CQSZACIVSA-N 353.407 2.600 50 40 FFGB CCCc1c(/C=N/NC(=O)c2ccncc2)c(OC)c2c(c1OC)OCO2 15086067 OHGBWRJOBUANNH-UFFVCSGVSA-N 371.393 2.544 50 40 FFGB COc1cccc2cc(C(=O)NNC(=O)c3ccc(Cl)cc3)c(=O)oc12 2283506 YHXSSXMOYGZBKK-UHFFFAOYSA-N 372.764 2.530 50 40 FFGB O=C(N/N=C/c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1O 4150770 CYBSYRXBKJCCJZ-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1C 6051612 QVQAHEMKLUADRK-UHFFFAOYSA-N 357.454 2.812 50 40 FFGB Cc1csc([C@@](O)(CC(=O)NNc2ccc(F)cc2)C(F)(F)F)n1 70011273 KOACBFAIBBRNPL-ZDUSSCGKSA-N 363.336 2.874 50 40 FFGB CCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1 408732550 WRAMBMSSCRUMET-LDADJPATSA-N 359.455 2.750 50 40 FFGB CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)N1CCOCC1 408754353 JWYNYUVZLUSDBP-UKTHLTGXSA-N 365.227 2.614 50 40 FFGB N#CCn1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])c2ccccc21 33608371 IZRKQXJZTHPANI-MTJSOVHGSA-N 361.361 2.766 50 40 FFGB O=C(O)CCc1ccc(NP(=O)(NCCCl)NCCCl)cc1 104391731 RWLZTGWPQWUQFX-UHFFFAOYSA-N 368.201 2.881 50 40 FFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1)c1ccccc1 7882511 PMKZDRKFPCPYBM-QGZVFWFLSA-N 373.412 2.654 50 40 FFGB O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)NNC(=O)C1CC1 55413526 YKLLPNJBOAXWOP-UHFFFAOYSA-N 369.368 2.929 50 40 FFGB Cc1cc(C)nc(NNC(=O)[C@H]2CC(=O)N(c3cccc(C(C)C)c3)C2)n1 12947940 JUHBXVZAXQABNJ-INIZCTEOSA-N 367.453 2.713 50 40 FFGB O=C(N/N=C/c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1cccnc1 13107239 UEOQXAHFABRAIU-UFFVCSGVSA-N 363.333 2.941 50 40 FFGB CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)[C@H](C)Cl 3887976 ALZZKNXHCOMPGP-LBPRGKRZSA-N 356.850 2.886 50 40 FFGB in-vitro C=CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)NCCOC 408820195 ULISKGPUNSWVHA-UKTHLTGXSA-N 365.227 2.683 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@@H]12)N/N=C1/C[C@@H]2C=CC[C@@H]12 225691270 GIRIUIXSQOYDQJ-WANXXYBSSA-N 354.454 2.683 50 40 FFGB Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C(\C#N)C(=O)N2CCOCC2)o1 843127 RBUFWUJAEHHFRG-GXDHUFHOSA-N 367.361 2.929 50 40 FFGB CCSc1nnc(S[C@H](C)C(=O)NNC(=O)c2ccccc2)s1 7060912 MCDOALRTPIYUMW-SECBINFHSA-N 368.509 2.592 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cncc(Br)c2)cc1OC 725836 GEKXKRPWUPYGSC-CNHKJKLMSA-N 364.199 2.625 50 40 FFGB Cc1noc(C)c1COc1ccccc1C(=O)NNC(=O)c1ccoc1C 22621630 KQJBLWJMUPJCCI-UHFFFAOYSA-N 369.377 2.847 50 40 FFGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(O)c(OC)c2)cc1OC 409320503 QBVUYJVOKKWRTO-NDENLUEZSA-N 356.378 2.738 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc([N+](=O)[O-])c1O 408857313 LVWXFYYVQZAXBN-KPKJPENVSA-N 369.333 2.950 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 409254774 ISTWPHOVPSMAKB-FEMWLQECSA-N 363.417 2.755 50 40 FFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)c(OC)c1 5413639 RSBQSFHSKLQIQQ-CIAFOILYSA-N 369.421 2.916 50 40 FFGB CC(=O)Nc1ccccc1NC(=O)C/C(C)=N/NC(=O)c1cccs1 100523047 QHMKMFBOFGGNGY-RGVLZGJSSA-N 358.423 2.841 50 40 FFGB COc1ccccc1CNC(=O)C/C(C)=N/NC(=O)c1cccc(C)c1O 4713791 RLNREOOAMPKMQL-HYARGMPZSA-N 369.421 2.521 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(C)c(Cl)c2)c1C 408969302 LGKMNCGSVJRXOB-SSDVNMTOSA-N 372.856 2.808 50 40 FFGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C1/C(=O)Nc2ccccc21 6191209 HDIZRYQZYNRYLF-UHFFFAOYSA-N 362.311 2.590 50 40 FFGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccc([N+](=O)[O-])cc1 408880649 GMBQUSIKHPVILT-OQLLNIDSSA-N 367.361 2.965 50 40 FFGB NC(=O)COc1ccc(/C=N/NC(=O)c2csc3ccccc23)cc1 32578446 DRWVUUCSZKQRGF-AWQFTUOYSA-N 353.403 2.529 50 40 FFGB COc1ccc(OCC(=O)N/N=C\c2ccc(Br)o2)cc1 33339495 RHEMSMHVHVXLLG-PXNMLYILSA-N 353.172 2.580 50 40 FFGB O=C(Cn1c(-c2ccccn2)nc2ccccc21)N/N=C/c1ccc(O)cc1 226864660 NEWNUEDJFLCLBF-YDZHTSKRSA-N 371.400 2.954 50 40 FFGB Cc1ccc(S(=O)(=O)OCC[C@H](CCBr)C(=O)O)cc1 642882612 RZOQDVDRUPBAGU-NSHDSACASA-N 365.245 2.576 50 40 FFGB N#Cc1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)c(Cl)c1 5938342 BAAGLNNLBOJZLU-UHFFFAOYSA-N 364.188 2.705 50 40 FFGB N#CC(C#N)=C(N)/C(C#N)=C/c1ccc(-c2cc(C(=O)O)cc(C(=O)O)c2)o1 100638451 MRLJNFHJAOYJBZ-AWNIVKPZSA-N 374.312 2.510 50 40 FFGB COc1ccc(O)c(/C=N/NC(=O)CCC(=O)Nc2cccc(C)c2)c1 1960217 VNCJEPFSMBRJPT-UDWIEESQSA-N 355.394 2.578 50 40 FFGB CCOC(=O)NNC(=O)c1sc2nc(C(C)(C)C)nc(C)c2c1C 36661096 RMBLVMYYIQXBQH-UHFFFAOYSA-N 350.444 2.997 50 40 FFGB Cc1ccc(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)c(C)c1 8474746 HNVOSKZUPCGDGB-XYVIHTCUSA-N 364.239 2.813 50 40 FFGB Cc1ccc(C)c2c(C)c(C(=O)NNC(=O)CN3CCCCCC3=O)oc12 65891251 CFPPQZPTNQKGGC-UHFFFAOYSA-N 371.437 2.522 50 40 FFGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1cccc(C(=O)O)c1 408543702 SGPYQTFCIVZZIO-SDQBBNPISA-N 353.290 2.544 50 40 FFGB CC1=C(C#N)[C@H](c2cccc([N+](=O)[O-])c2)C(C(=O)OCCC#N)=C(C)N1 59231201 PHQZIBXHYSVCRJ-KRWDZBQOSA-N 352.350 2.810 50 40 FFGB biogenic O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc([N+](=O)[O-])o1 3577080 FJOUVIRSOWHOLN-FBCYGCLPSA-N 356.260 2.769 50 40 FFGB O=C(N/N=C/c1ccc(-c2ccc(O)c(C(=O)O)c2)o1)c1cccnc1 809057 QMJXGEYVUZCANE-KEBDBYFISA-N 351.318 2.509 50 40 FFGB CCOc1cccc(OCC)c1[C@@H]1C(C#N)=C(N)Oc2oc(C)cc(=O)c21 1073919 OMGUTEVRYURYBF-MRXNPFEDSA-N 368.389 2.964 50 40 FFGB C/C(CC(=O)NC12CC3CC(CC(C3)C1)C2)=N\NC(=O)c1ccncc1 100089626 MOLKZHFVYNKRSD-YDZHTSKRSA-N 354.454 2.662 50 40 FFGB CC(C)c1c(C(=O)NNC(=O)c2ccco2)cnn1-c1ccc(F)cc1 24487568 ZEVJNIQZCLYMBZ-UHFFFAOYSA-N 356.357 2.803 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc(Cl)c1OC 13137313 RQPYVWAYRZYMRG-GUNGLEHYSA-N 364.829 2.949 50 40 FFGB COc1ccccc1[C@@H]1[C@H](C(=O)C2CC2)N2C=C(C#N)C=C[C@@H]2C1(C#N)C#N 4729603 VTGZRMNOOGIDGF-VAMGGRTRSA-N 370.412 2.822 50 40 FFGB O=C(NNS(=O)(=O)c1ccc(Cl)cc1)C12CC3CC(CC(C3)C1)C2 5945007 IOURJVLXKPJBOP-UHFFFAOYSA-N 368.886 2.866 50 40 FFGB COc1ccc(OCC(=O)N/N=C(\C)c2ccc(NC(C)=O)cc2)cc1 408869531 PUZXLLNZZUSEBO-FYJGNVAPSA-N 355.394 2.573 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1O 59333394 GCAZTPKPBIRJJA-LGMDPLHJSA-N 363.417 2.657 50 40 FFGB O=C(NNS(=O)(=O)c1cccc(F)c1)c1cc2c(s1)CCCCC2 12994596 YWKRLAACCNMNGW-UHFFFAOYSA-N 368.455 2.779 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)c2ccccc21 15823810 BGEFFUXKUCLHIJ-KRWDZBQOSA-N 369.808 2.596 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc2c1OCO2 408544793 XKFGEKNPAAYBJH-ACAGNQJTSA-N 366.329 2.668 50 40 FFGB O=C(CN1CCCCC1)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCCC1 408998044 QAUZSFATKPJKOX-XSFVSMFZSA-N 373.457 2.521 50 40 FFGB CCOC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccc(CC)cc2)cc1 223155892 KPHIROYETRVGEW-BKUYFWCQSA-N 367.405 2.515 50 40 FFGB CCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccc(Cl)cc2)c1C 2686089 UKBFQLTURBRXAB-UHFFFAOYSA-N 363.801 2.536 50 40 FFGB C[C@@H]1CCC/C(=N\NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 33042660 UPJKIARQFPEHDN-RKDSPFTASA-N 363.483 2.767 50 40 FFGB CC1(CC(=O)N/N=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)OCCCO1 59426571 RAAYPQKPOACCFH-XDHOZWIPSA-N 373.365 2.848 50 40 FFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@H](c1ccccc1)C(C#N)=C(N)O2 1471754 ASBNKXCCEQIFJV-LJQANCHMSA-N 370.412 2.818 50 40 FFGB CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)c3cnsn3)cc2C1 58423824 YOVCEMBDFQJZCM-SNVBAGLBSA-N 364.496 2.825 50 40 FFGB Cc1cc(C)nc(NNC(=O)[C@@H]2CC(=O)N(c3cccc(C(C)C)c3)C2)n1 12947944 JUHBXVZAXQABNJ-MRXNPFEDSA-N 367.453 2.713 50 40 FFGB CCN(CC)c1ccc([C@@H]2C(C#N)=C(O)NC(=O)[C@@H]2[n+]2ccccc2)cc1 4561442 ZAGUSYJLZUEAIH-RTBURBONSA-O 363.441 2.568 50 40 FFGB CCOc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc([N+](=O)[O-])c1O 409240377 TULGMRRSAGCLOM-GRSHGNNSSA-N 361.329 2.531 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)[C@@H]1[C@@H]2CCCC[C@@]21C 408722434 IVQJTYNCUVQSMB-FZXIHYQPSA-N 361.398 2.888 50 40 FFGB Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)C3CCOCC3)cc2)cc1 60668143 DVKZVNXOOVCDSU-UHFFFAOYSA-N 374.462 2.698 50 40 FFGB O=c1[nH]cnc2[nH]c(-c3ccc(N(CCCl)CCCl)cc3)nc12 4440578 QLMSGIGJKNBEGK-UHFFFAOYSA-N 352.225 2.597 50 40 FFGB CCC(=O)N1CCN(c2ccccc2[C@@H]2C[C@@H](C(=O)Cl)CC2=O)CC1 57328020 RZXGKWKGMYYWGI-HIFRSBDPSA-N 362.857 2.573 50 40 FFGB O=C(N/N=C/c1ccc(F)cc1)C1CCN(C(=O)c2ccc(F)cc2)CC1 409004946 GLEQNVNEBKMORH-YDZHTSKRSA-N 371.387 2.967 50 40 FFGB CCN(CC)c1ccc([C@H]2C(C#N)=C(O)NC(=O)[C@H]2[n+]2ccccc2)cc1 4561437 ZAGUSYJLZUEAIH-OALUTQOASA-O 363.441 2.568 50 40 FFGB C#CCOc1ccc(/C=C(\C#N)C(=O)NCc2ccco2)cc1OCC 21274469 PFMNUNPYEWXKRE-LFIBNONCSA-N 350.374 2.914 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccccc2OC(F)F)n1 6942587 LMPOFGVXVHNJAF-UFWORHAWSA-N 366.393 2.937 50 40 FFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccc(OCC)cc2)CC(=O)N1 9110529 WEVSSVOXEUHILZ-AWEZNQCLSA-N 360.435 2.720 50 40 FFGB O=C(CCC(=O)Nc1ccc(F)cc1)N/N=C/c1cccc([N+](=O)[O-])c1 1949144 LHFATMUGAUEBHF-YBFXNURJSA-N 358.329 2.603 50 40 FFGB Cc1ccc(S(=O)(=O)Oc2ccc(/C=N/NC(=O)C(C)C)cc2)cc1 59154685 MBEJZXZFDDYHGW-XDHOZWIPSA-N 360.435 2.869 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)N(C)C)c(Br)c(Cl)c1O 408850863 SLPSMDNNNCJXHK-YWEYNIOJSA-N 359.607 2.812 50 40 FFGB CC1CCN(c2ccc([N+](=O)[O-])cc2/C=N/NC(=O)c2ccncc2)CC1 409275235 ZPOVKNGRNKNSMY-FYJGNVAPSA-N 367.409 2.990 50 40 FFGB C[C@@H](SCc1ccccc1)C(=O)NNC(=O)c1cc(Cl)cn1C 44379063 AQNVSWTWLGSCNO-LLVKDONJSA-N 351.859 2.761 50 40 FFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)c2ccco2)c2ccccc21 14134791 UMFFYFTVMMUYDJ-RGVLZGJSSA-N 353.378 2.870 50 40 FFGB CC(=O)NNc1nc(C)c(C(=O)/C=C/c2ccc(NC(C)=O)cc2)s1 16957602 KYHRNORUBPIMGG-RMKNXTFCSA-N 358.423 2.769 50 40 FFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)c1 3067273 QVHKUEVHHQPPCN-CIAFOILYSA-N 369.421 2.916 50 40 FFGB CNC(=O)/C(C#N)=C/c1ccc(OCc2ccc(C(=O)O)cc2)c(OC)c1 111459105 FORBCSHHSOMWCK-CXUHLZMHSA-N 366.373 2.625 50 40 FFGB Cc1cc(/C=N/NC(=O)CN2CCOCC2)c(C)n1-c1cccc(Cl)c1 28216606 RIMKSHNLLHFIQA-CIAFOILYSA-N 374.872 2.530 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)Cc3ccccc3F)ccc21 2618025 BTLNTCUFGLJMQU-UHFFFAOYSA-N 354.385 2.507 50 40 FFGB NC(=O)[C@@H](Br)C12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2 3895362 KARJLQXIQFBVED-RORBGTHESA-N 351.082 2.969 50 40 FFGB O=C(CBr)NCC(F)(F)C(F)(F)C(F)(F)C(F)F 103711436 HPWSDGSHMCONMH-UHFFFAOYSA-N 352.019 2.669 50 40 FFGB Cc1cccc(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)c1 8474820 CNZKMXHHLBQMEK-OKDXSUHISA-N 350.212 2.505 50 40 FFGB CCOC(=O)/C(=C/NNC(=O)c1ccc(Cl)cc1)C(=O)c1ccccc1 408895211 UGUSUVUHFKARKQ-FOWTUZBSSA-N 372.808 2.904 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc3c(c2)OCCO3)cc1 102804594 VMXIAUDZBMEFRZ-FOWTUZBSSA-N 372.402 2.717 50 40 FFGB CSc1ncccc1C(=O)NNC(=O)c1ccc(Br)cc1 3412066 ZRLFILRTBXBTJK-UHFFFAOYSA-N 366.240 2.641 50 40 FFGB Cc1c(C(=O)N/N=C/c2ccc(Br)o2)sc(N)c1C#N 408723731 GBFSICWFHGZROZ-FZSIALSZSA-N 353.201 2.630 50 40 FFGB CCOc1cccc(/C=N\NC(=O)C(=O)Nc2ccc(Cl)cc2)c1O 223150152 LZXSIQXONQIHOP-GRSHGNNSSA-N 361.785 2.533 50 40 FFGB O=C(CCNC(=O)OCC(F)(F)F)NNc1ccccc1C(F)(F)F 57200482 MPIYEWGGIXLXKJ-UHFFFAOYSA-N 373.253 2.827 50 40 FFGB C#CCOc1ccccc1/C=N\NC(=O)c1ccc(OC)c(OCC)c1 6355016 UVBYNYXBRXNMSF-STZFKDTASA-N 352.390 2.870 50 40 FFGB COc1ccc(O)c(/C(C)=N/NC(=O)c2cc(Br)cn2C)c1 102208610 GWPSRQBNTIBYOR-RQZCQDPDSA-N 366.215 2.656 50 40 FFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)cc1 9232159 LGDQQVYUDHRXKC-WSDLNYQXSA-N 373.840 2.895 50 40 FFGB COC(=O)c1cccc2[nH]cc(/C=C(\C#N)C(=O)Nc3cc(C)on3)c12 49547712 VRRNFMHWVALYGY-YRNVUSSQSA-N 350.334 2.797 50 40 FFGB CC(C)(C)C(CBr)(N(CC(=O)O)CC(=O)O)C(C)(C)C 1570001679 GUXWSFYZANRKAH-UHFFFAOYSA-N 352.269 2.684 50 40 FFGB C[C@@H](C(=O)N/N=C/c1c[nH]c2ccccc12)n1cnc2ccccc2c1=O 949526 IMVYDLSZFTZSSH-HKNSOBRKSA-N 359.389 2.589 50 40 FFGB C/C(=N\NC(=O)c1c(Br)cnn1C)c1ccc(Cl)cc1 17073533 UEGUMVWRSXYWNU-CAOOACKPSA-N 355.623 2.990 50 40 FFGB C[C@H]1C[C@H](C)CN(C(=O)COC(=O)/C(C#N)=C\c2ccc(N(C)C)cc2)C1 35059447 PLAIMSXANCZSMY-AWJYWUTJSA-N 369.465 2.707 50 40 FFGB N#C/C(=C\c1c[nH]c2ccc(Br)cc12)C(=O)N1CCOCC1 4318533 JXBUAWZOQSEWGW-YRNVUSSQSA-N 360.211 2.696 50 40 FFGB CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(C(=O)OC)cc2)C1=O 8993614 SMTWPWHGGOIHER-UEMWTREESA-N 367.405 2.776 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2cc(C)ccc2C)c([N+](=O)[O-])cc1OC 409359228 AKNISUGVXNTKHB-RGVLZGJSSA-N 371.393 2.922 50 40 FFGB COc1cc2c(cc1/C=N/NC(=O)COc1ccccc1Cl)OCO2 409104399 YXRSNTAUQJJCAE-UFWORHAWSA-N 362.769 2.606 50 40 FFGB CCOc1cccc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)c1O 4735392 ONNVMWWHZSTQNK-UDWIEESQSA-N 358.394 2.501 50 40 FFGB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)NNC(=O)c1cncn1-c1ccc(F)cc1 103323556 MNPYEKOXSVGOQB-MELADBBJSA-N 356.401 2.599 50 40 FFGB O=C(N/N=C/c1cc(Br)cc(Cl)c1O)c1ccccn1 2307984 GELQLKCUGSSWJX-REZTVBANSA-N 354.591 2.967 50 40 FFGB N#C/C(=C/c1ccc(-c2ccc(I)cc2)o1)C(N)=O 208830788 IPGHZPPGZFSNBW-YFHOEESVSA-N 364.142 2.943 50 40 FFGB O=C(N/N=C/c1ccc(F)cc1)C(=O)Nc1ccc(Br)cc1 59515418 GXTULXULGGGSPE-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB CC(C)=Nc1ccccc1C(=O)NNC(=O)/C(O)=C/C(=O)c1ccccc1 100933521 YNPAVMSIJIGUTH-PDGQHHTCSA-N 365.389 2.885 50 40 FFGB Cn1ncc2c1CCC/C2=N/NC(=O)COc1ccc(C(C)(C)C)cc1 43915900 GRKPFFPOZRUCFX-XLNRJJMWSA-N 354.454 2.953 50 40 FFGB COc1ccccc1/C=N/NC(=O)c1cc2c(OC)ccc(OC)c2[nH]1 2219710 PEPSPSTTXYUAJW-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB Cc1cccc(NC(=O)/C(C#N)=C\c2cn(CC(N)=O)c3ccccc23)c1 33726390 MMJGJDQTNXQUCD-GDNBJRDFSA-N 358.401 2.981 50 40 FFGB COc1ccc(/C=N\NC(=O)COc2ccc(C)cc2C)cc1[N+](=O)[O-] 30843122 XHFNINAUQRHXDO-GRSHGNNSSA-N 357.366 2.749 50 40 FFGB CN1C(=O)/C(=N/NC(=O)CNc2cccc3ccccc23)c2ccccc21 12416827 SRNPJYQZMDSKKC-HIXSDJFHSA-N 358.401 2.749 50 40 FFGB CCN(CC)N(C(C)=O)[C@H]1C[C@H](c2ccccc2)C(C#N)(C#N)C1(C#N)C#N 2273537 APBGEMOUPARITI-MOPGFXCFSA-N 374.448 2.715 50 40 FFGB CCCN1C(=O)/C(=N/NC(=O)CNc2ccccc2C)c2ccccc21 100863123 JKZOCVZERIMJRE-FCDQGJHFSA-N 350.422 2.684 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc(Cl)c1O 13096675 XZSPSGDCAYBJRT-UWUHSAQLSA-N 350.802 2.646 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(N(C)C)o2)c(OC)c1 408872580 GSJHLMLHRAKIRW-NTEUORMPSA-N 355.394 2.586 50 40 FFGB COc1ccc(OCC(=O)NNC(=O)Cc2cccc3ccccc23)cc1 5513858 AJFZUVHVEKWQHJ-UHFFFAOYSA-N 364.401 2.617 50 40 FFGB CCC(=O)Nc1ccc(C(=O)NNC(=O)/C=C/c2ccccc2OC)cc1 4734391 YHHMZVFWQATBMM-JLHYYAGUSA-N 367.405 2.518 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 826011 MZUIIYVTSBQIIK-GKXUUXLPSA-N 351.406 2.507 50 40 FFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2)nc2c(C)cccn2c1=O 2405756 ZLYFDJBWHOXEBN-NTCAYCPXSA-N 374.400 2.838 50 40 FFGB Cc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 1575312 HDRWRVXBXJNAHF-GIJQJNRQSA-N 360.757 2.645 50 40 FFGB CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNc2nc(C)cc(C)n2)cc1 40153405 OOROPFNPUMYSBN-LBPRGKRZSA-N 359.455 2.676 50 40 FFGB COc1cccc(Cn2cc(/C=N/NC(=O)C(C)(C)O)c3ccccc32)c1 32578404 VKLKCWOUVQLHOQ-WSDLNYQXSA-N 365.433 2.919 50 40 FFGB Cn1cc(C(=O)NNC(=O)c2cc(-c3cccs3)on2)c2ccccc21 54678222 ORFWBOWQCFTHBO-UHFFFAOYSA-N 366.402 2.970 50 40 FFGB COc1cn(-c2ccccc2)nc1C(=O)NNc1ccccc1[N+](=O)[O-] 15631741 NBVSNJZXDCQQFO-UHFFFAOYSA-N 353.338 2.546 50 40 FFGB Cc1n[nH]c2c1[C@H](c1ccc(OC(=O)c3ccco3)cc1)C(C#N)=C(N)O2 9704004 YNUGWMQBQHUMLQ-MRXNPFEDSA-N 362.345 2.749 50 40 FFGB O=C(N/N=C/c1ccco1)c1nc2ccccc2c(=O)n1Cc1ccccc1 28218255 HNPUMEPUZWERFB-LPYMAVHISA-N 372.384 2.802 50 40 FFGB COc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=O)CC#N)cc1 3313128 BSCDHAJSIXYRTQ-LPYMAVHISA-N 359.389 2.912 50 40 FFGB O=C(CCl)N(c1cc(Cl)cc(Cl)c1)[C@H]1CCS(=O)(=O)C1 40177571 BXRINKAKAHCGHF-JTQLQIEISA-N 356.658 2.752 50 40 FFGB C/C(=N\NC(=O)C(C)C)c1ccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 16323432 CINOZGMIXOEEPC-MCVCKHRISA-N 355.438 2.862 50 40 FFGB O=C(/C=C/c1c(Cl)nc2ccccn12)NNC(=O)c1ccccc1F 8273979 MVKQWUSWYKAWIV-CMDGGOBGSA-N 358.760 2.601 50 40 FFGB O=C(N/N=C/c1c(O)ccc2ccccc12)c1[nH]ncc1Br 1498352 XTTLUNFROHAZTJ-REZTVBANSA-N 359.183 2.795 50 40 FFGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COC(=O)c1cn3ccccc3n1)C2 58140990 MQNPINJPANDZCI-YFFBDIQFSA-N 368.437 2.810 50 40 FFGB CC(C)n1nc(C(=O)N/N=C/c2ccc(C#N)cc2)c2ccccc2c1=O 7785426 WJLCPAAIVDRXPW-WSDLNYQXSA-N 359.389 2.613 50 40 FFGB Cc1cccc(C(=O)N/N=C\c2ccc(I)o2)c1 206208289 SQLBAYKPXSCEKN-NVNXTCNLSA-N 354.147 2.957 50 40 FFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1ccccc1Br 4721138 VLLNQDAPLIDOBH-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CCCCCCCCC(=O)Nc1ccccc1C(=O)NNS(C)(=O)=O 102033678 OQJDCMCUNIAOAG-UHFFFAOYSA-N 369.487 2.570 50 40 FFGB C/C(=N\NC(=O)OC(C)(C)C)c1ccc(S(=O)(=O)N2CCCC2)cc1 24035801 DVRAVPVHMLHKLP-QGOAFFKASA-N 367.471 2.720 50 40 FFGB Cc1cccc(-n2ncc3c(NNC(=O)c4cccs4)ncnc32)c1 4355160 RVUZMEZMNMEVFW-UHFFFAOYSA-N 350.407 2.942 50 40 FFGB Cc1ccc(-n2ncc(C(=O)NNC(=O)c3ccc(F)cc3)c2C)cc1 13019420 VLVZPIWPALTVNM-UHFFFAOYSA-N 352.369 2.703 50 40 FFGB COc1ccccc1NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C 15423062 ZGICYZFMDUZTCF-CQSZACIVSA-N 371.275 2.950 50 40 FFGB CCN(CC)C(=O)/C(C#N)=C/c1cc(O)c(OC)cc1Br 7000865 QCPDQTACOAPTRC-IZZDOVSWSA-N 353.216 2.939 50 40 FFGB COc1ccc(CCC(=O)NNC(=O)c2cc3ccccc3cc2O)cc1 8156584 MEOZCCKZKBTTJR-UHFFFAOYSA-N 364.401 2.948 50 40 FFGB CCOC(=O)N/N=C(\C)c1ccc(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 101642687 OATKSAVZVHIREP-BXRKRMDBSA-N 357.410 2.836 50 40 FFGB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)N/N=C1/C[C@H]2CC[C@@]1(C)C2(C)C 102918743 MPYPAMMYVWZEKS-VDDUVEBZSA-N 374.437 2.732 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c2C)c(C)c1 58903909 WQIFXIPLTLFHDQ-FSJBWODESA-N 368.481 2.933 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2ccc(Br)cc2)cc1 3151059 GEMUTGXPCLSNNZ-VCHYOVAHSA-N 361.195 3.000 50 40 FFGB O=C(CSc1nc2ccccc2o1)N/N=C/c1cc([N+](=O)[O-])ccc1O 2200105 QMERIQAQRKFQAW-CAOOACKPSA-N 372.362 2.684 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccccc2F)c1C 408934953 DRXLGANPHBKTAQ-OVMKCGGTSA-N 358.417 2.598 50 40 FFGB Cc1ccccc1CSCC(=O)N/N=C/c1ccc(N2CCOCC2)o1 408994583 IBWOOEHZLPSJDS-UDWIEESQSA-N 373.478 2.808 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)C(=O)Nc1ccc(O)cc1 33692729 LZHFWARYRZNETG-GHXNOFRVSA-N 369.333 2.863 50 40 FFGB O=C(COC(=O)c1ccccn1)NN=C(c1ccccc1)c1ccccc1 11077639 JTTPZMOPZJNAHH-UHFFFAOYSA-N 359.385 2.807 50 40 FFGB COc1ccccc1/C=N/NC(=O)COc1cccc(Br)c1 969243 RHGXMFUNFPGWPY-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB CCc1cc2c(=O)n(CC(=O)N/N=C\c3ccccc3Cl)cnc2s1 31783533 OYHSKMVTUQFXFU-ZBKNUEDVSA-N 374.853 2.824 50 40 FFGB O=C(CC(=O)NC1CCCCC1)N/N=C/c1cccc(Br)c1 5568426 XQELQWGGPVGXMY-WOJGMQOQSA-N 366.259 2.738 50 40 FFGB CC(=O)O[C@H]1[C@@H]2C[C@@H]([C@@H]1Br)C(C(F)(F)F)(C(F)(F)F)N2 100145284 FCKCEYSPFMHAJD-AXMZGBSTSA-N 370.087 2.537 50 40 FFGB O=C(COc1cccc(F)c1)NNC(=O)c1ccc(Cl)c(Cl)c1 2630770 QTWAEVDKMJUOKE-UHFFFAOYSA-N 357.168 2.973 50 40 FFGB COc1cc(/C=N/NC(=O)COc2ccc(C)cc2)cc(OC)c1OC 3087588 GEUWHMHYFRXFQU-RGVLZGJSSA-N 358.394 2.550 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 59503544 JLJQODNWMREXGK-DJKKODMXSA-N 358.419 2.807 50 40 FFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2cn(CC#N)c3ccccc23)cc1 107912517 MOPGRQXRIHAFNN-WSDLNYQXSA-N 359.389 2.887 50 40 FFGB CC(C)(C)c1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1 2135417 RGFFXXFDZKRXEE-UHFFFAOYSA-N 361.492 2.995 50 40 FFGB aggregator COCC1=C(C(=O)OC)[C@H](c2cccc3ccccc23)C(C#N)=C(N)O1 4189180 YDEOCHPWIMGSML-QGZVFWFLSA-N 350.374 2.721 50 40 FFGB C[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C1CC1 84636359 NMVBOPIKROGZEK-CYBMUJFWSA-N 352.438 2.572 50 40 FFGB N#CC1=C(N)N(c2nc[nH]n2)C2=C(C(=O)CCC2)[C@@H]1c1ccc(Cl)cc1 5522208 LIKGBTNXAGPSHM-OAHLLOKOSA-N 366.812 2.763 50 40 FFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccccc2N)c2ccccc21 6318978 FYHGBIICIYWEQK-SSDVNMTOSA-N 364.405 2.551 50 40 FFGB COc1ccc(C(=O)NNC(=O)COc2cccc3ccccc23)cc1 1088051 QFADXGPAOVXIDQ-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB COC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1 3243942 UOFZAPOKSJEQSB-UUILKARUSA-N 351.982 2.607 50 40 FFGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)c1C 18209532 LJEGKZDYHJQTIN-DJKKODMXSA-N 357.366 2.755 50 40 FFGB COc1cccc(/C=N/NC(=O)c2ccc(C)cc2)c1O[C@@H](C)C(=O)O 409243355 VVSZHLBOMLVXSI-HSWQHBDASA-N 356.378 2.619 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(Cl)cc2)c1 408609661 KXYWTGLADWQUDP-SRZZPIQSSA-N 359.813 2.505 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccccc3Cl)CC2=O)cc1 3176524 DSNUUKPVZOWRQM-FVUPAENESA-N 371.824 2.852 50 40 FFGB Cc1ccc(C[C@H]2S/C(=C(/C#N)C(N)=O)N(c3ccccc3)C2=O)cc1 2337788 XTGIIRBZBUNRQI-XUMLYMLNSA-N 363.442 2.907 50 40 FFGB C[C@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1O 5172075 PACQUCIPRCUJHY-JTQLQIEISA-N 350.827 2.987 50 40 FFGB Cc1cc(C(=O)NNS(=O)(=O)/C=C/c2ccc(Cl)cc2)c(C)o1 8762877 RWCSGEOYNYECAN-BQYQJAHWSA-N 354.815 2.785 50 40 FFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)c1O 4199359 OPMSNEZBARRPKE-RGVLZGJSSA-N 355.394 2.613 50 40 FFGB Cc1ccccc1-c1nnc(SCC(=O)NNC(=O)c2ccccc2)o1 5434788 VHIQGVKKQIZJRT-UHFFFAOYSA-N 368.418 2.598 50 40 FFGB N#C/C(=C/c1ccccc1[N+](=O)[O-])C(=O)N1CCN(c2ccccc2)CC1 59332815 QIWSERQPMRDRIW-VKAVYKQESA-N 362.389 2.851 50 40 FFGB N#CC(C(=O)COC(=O)c1n[nH]c2ccccc12)=C1Nc2ccccc2N1 6565869 BQYTVPGGIUORPO-UHFFFAOYSA-N 359.345 2.562 50 40 FFGB COc1cccc([C@H]2[C@@H]3C(=C[C@@H]4CC[C@@H]3N4C)C(C#N)=C(N)C2(C#N)C#N)c1 100213652 FECXSRCBUAIHFT-GAZPGATBSA-N 371.444 2.581 50 40 FFGB Cc1nc(C)c(C(=O)NNC(=O)c2ccc(Br)cc2)s1 3203508 IZAITQYVZMCJEY-UHFFFAOYSA-N 354.229 2.597 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(OC)cc1 4502843 NTKPGOKDFUDETA-OAHLLOKOSA-N 370.434 2.643 50 40 FFGB CCO[C@]1(c2ccccc2)C[C@H]1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 4935951 SDYRFMRPNJOSNS-AVDJQCOYSA-N 353.378 2.997 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc1 409361418 HDULWICSPSNXLP-JCMHNJIXSA-N 367.449 2.997 50 40 FFGB O=C(NCc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1ccc(F)cc1 408718529 VOBUBABEFMGRHR-ODCIPOBUSA-N 368.195 2.899 50 40 FFGB COc1cc(C(=O)N/N=C/c2c[nH]c3ccccc23)cc(OC)c1OC 694598 VHTOJACGUMRGKR-SRZZPIQSSA-N 353.378 2.958 50 40 FFGB COC(=O)Cc1[nH]nc2c1[C@@H](c1ccc(C(C)(C)C)cc1)C(C#N)=C(N)O2 803866 JLIINJWUYXUEQI-INIZCTEOSA-N 366.421 2.641 50 40 FFGB O=C(COC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccccc1 3300436 LPTCNCQUMBCDGC-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc(Br)c(N(C)C)o2)cc1 59105215 POOCYMWSIVRNSF-RQZCQDPDSA-N 366.215 2.881 50 40 FFGB CCOC(=O)COc1ccc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc1 409360437 FLFNCJSOJHZSDG-XKZIYDEJSA-N 368.433 2.938 50 40 FFGB COC(=O)c1cccc(/C=N/NC(=O)c2c(C)nc3ccc(Cl)cn23)c1 408973762 UWHRKDOMGRTPOW-AWQFTUOYSA-N 370.796 2.847 50 40 FFGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cc(O)ccc2[N+](=O)[O-])c1C 12859174 JXKBAUBYFLZZFQ-DJKKODMXSA-N 357.366 2.755 50 40 FFGB O=C(N/N=C/c1ccco1)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 55252919 DTDKDLPJQILGFY-XDHOZWIPSA-N 356.382 2.550 50 40 FFGB N#C/C(=C/c1cccc(OCC(N)=O)c1)C(=O)Nc1ccc(Cl)cc1 409225093 OSDOUPOXGZABHZ-JYRVWZFOSA-N 355.781 2.750 50 40 FFGB Cn1cccc1-c1cc(C(=O)N/N=C/c2cccc(Br)c2)[nH]n1 8560164 IQMRFELEUOLRFF-VCHYOVAHSA-N 372.226 2.942 50 40 FFGB COc1cc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc([N+](=O)[O-])c1O 216041768 HBLYTRURWGAHSU-GRSHGNNSSA-N 357.366 2.619 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2cccc(F)c2)cc1 100522573 JIXOEAIMXPLFPU-LPYMAVHISA-N 357.385 2.647 50 40 FFGB O=C(NNC(=S)NC(=O)c1cccc2ccccc12)c1cccs1 1861380 XADONBZMZOBVRJ-UHFFFAOYSA-N 355.444 2.851 50 40 FFGB COc1ccc(N[C@@H](C)C(=O)N/N=C(\C)c2ccc([N+](=O)[O-])cc2)cc1 662801 MCZJXCZTDMPGGW-DZUMZMOTSA-N 356.382 2.944 50 40 FFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@]21C(=O)Nc2cc(Cl)ccc21 687134 DZQJECSUUILFIY-IBGZPJMESA-N 369.808 2.897 50 40 FFGB C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)c1cc(Cl)ccc1O 4124068 UBYMYPRRVLLMAO-SRZZPIQSSA-N 360.801 2.884 50 40 FFGB C[C@H](SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1)C(=O)Nc1ccccc1 7252411 GXFTUMNLZBYUMN-AAEUAGOBSA-N 354.435 2.778 50 40 FFGB Cn1cc(/C=N/NC(=O)COc2ccc([N+](=O)[O-])cc2)c2ccccc21 5337989 ICYFOGUFOLHRIX-VXLYETTFSA-N 352.350 2.616 50 40 FFGB C/C(=N\NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(F)cc1 6369290 PYDMHWQZHLVFSO-HAVVHWLPSA-N 368.456 2.878 50 40 FFGB NNC(=O)c1cn(C(=O)Cc2ccc(Br)cc2)c2ccccc12 226366219 BVRAMSRDSHDKPZ-UHFFFAOYSA-N 372.222 2.890 50 40 FFGB O=C(CCl)Nc1c(C(=O)Nc2ccccc2)nnn1Cc1ccccc1 1080841 KYCKEYCSHMKWDY-UHFFFAOYSA-N 369.812 2.756 50 40 FFGB CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)c3cccc[n+]3[O-])cc2C1 44980323 PFIUUBDKIYEUNZ-CYBMUJFWSA-N 373.478 2.607 50 40 FFGB CN(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)cc1 4869470 DUEZSFFWFUGYCU-UKTHLTGXSA-N 352.350 2.912 50 40 FFGB Cc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)NC(C)C)cc2)cc1 83261720 ZRQQVGRNMOOHMM-MTJSOVHGSA-N 353.422 2.662 50 40 FFGB O=C(NNc1nc2c(F)cc(F)cc2s1)[C@@H]1COc2ccccc2O1 4121500 BVWHGNUNLSHAIW-LBPRGKRZSA-N 363.345 2.858 50 40 FFGB CCCOC(=O)c1ccc(OCC(=O)N/N=C2\CC(=O)CC(C)(C)C2)cc1 100023152 WBANNOSWBOYEII-RCCKNPSSSA-N 374.437 2.884 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2c(C)cccc2C)c1C 58913975 GDDPQGIDRAYZLY-QRVIBDJDSA-N 366.465 2.853 50 40 FFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)=C(c3cccs3)[C@@H]2C1 4354133 NTERRWNXTAYODR-CQSZACIVSA-N 352.419 2.790 50 40 FFGB Cc1ccc(N(CC(=O)NN=C2CCCCCCC2)S(C)(=O)=O)cc1 6204633 DFVUVOBNFMXEDP-UHFFFAOYSA-N 365.499 2.978 50 40 FFGB C[C@H](Cl)C(=O)NCCNC(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1 65549738 SOVWOOFLXAHZIV-UWVGGRQHSA-N 365.783 2.809 50 40 FFGB Cc1nnc(SCC(=O)NNC(=O)c2ccccc2)n1C1CCCCC1 5865272 FDUWXRROASWJSJ-UHFFFAOYSA-N 373.482 2.645 50 40 FFGB CCOC(=O)C1=C(C)NC(C(C#N)C#N)=C(C#N)[C@H]1c1ccc(F)cc1 100249141 UAJRVUKCLNLTBH-QGZVFWFLSA-N 350.353 2.791 50 40 FFGB CCCOc1ccc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)cc1 3187127 OYEBASPPQRGFIM-UHFFFAOYSA-N 374.418 2.845 50 40 FFGB Cc1ccc(NC(=O)[C@H](NNC(=O)c2cccn2C)c2ccccc2)cc1 32814712 RMIUQFRRPCSZDF-LJQANCHMSA-N 362.433 2.948 50 40 FFGB C#CCN1C(=O)/C(=N/NC(=O)c2ccccc2-n2cccc2)c2ccccc21 18090680 FCACLNRJCWMCEO-BSYVCWPDSA-N 368.396 2.591 50 40 FFGB Cc1nc(C2CC2)nc2sc(C(=O)NNC(=S)NC(C)C)c(C)c12 24825158 YCAUWSDISZIVSE-UHFFFAOYSA-N 363.512 2.703 50 40 FFGB C[C@H]1CCC[C@@H](C)N1C(=O)COC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1 97664033 FLVIPETUBIXORZ-UCHUYYQMSA-N 369.465 2.992 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)CCc1ccccc1 6295396 KGHYOVSXSKJFDG-XSFVSMFZSA-N 351.362 2.690 50 40 FFGB O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)c1ccncc1 2543600 CVSCFAPCBARDGW-UHFFFAOYSA-N 356.329 2.612 50 40 FFGB Cc1cc2c(c(=O)o1)[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 714324 AURMXPOPZYMGQV-ZDUSSCGKSA-N 359.725 2.728 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)c(O)c1 6629965 SALPHAQSFDWNPR-SDLXJUDFSA-N 350.422 2.996 50 40 FFGB C/C(=N\NC(=O)C(C)C)c1ccc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 101638366 CINOZGMIXOEEPC-JVAFHNLNSA-N 355.438 2.862 50 40 FFGB CCOc1cc(C=NNC(N)=O)ccc1OCCOc1ccccc1C 4196618 RAPNHDUZGYUNNN-UHFFFAOYSA-N 357.410 2.854 50 40 FFGB COc1ccc(C)cc1C(=O)CCC(=O)NNC(=O)c1cc(C)oc1C 6509902 JSJUGVDEAAJFSJ-UHFFFAOYSA-N 358.394 2.638 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1ccc([N+](=O)[O-])o1)CO2 5642775 ZEHOUGILTBBWID-VRKJEAOJSA-N 373.365 2.775 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)CNc2ccc(C)cc2)c2ccccc21 15517156 OSRBFSYNYHLYAC-NMWGTECJSA-N 350.422 2.684 50 40 FFGB CC(C)CC(=O)N/N=C/c1ccc(OCC(=O)NCc2ccccc2)cc1 20244085 IIUBIAXQBWVLLL-OEAKJJBVSA-N 367.449 2.878 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)OCC(=O)N(C)C2CCCCC2)cc1 35329975 LODPHOWIQIBNEU-VBKFSLOCSA-N 356.422 2.936 50 40 FFGB COc1cc(/C=N\NC(=O)c2cccs2)cc(Br)c1O 30728615 RJMUCMZLPBOFRN-CHHVJCJISA-N 355.213 2.989 50 40 FFGB COc1ccc([C@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)cc1 12275727 QDPNVWXVENURPF-KUHUBIRLSA-N 368.414 2.931 50 40 FFGB O=C(NNC(=O)c1ccccc1Cl)c1ccc(OC[C@H]2CCCO2)cc1 13619607 RKZRCPBBQZSFHF-OAHLLOKOSA-N 374.824 2.973 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(OCC)cc1 20763779 ABFKYEADYYRTFM-DEDYPNTBSA-N 367.361 2.769 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)C2C3CC4CC(C3)CC2C4)cc1OC 32819062 VUZOPFWNZLOPTL-UHFFFAOYSA-N 372.465 2.927 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 8169071 YJUJLWFFXKYHKU-FVUPAENESA-N 371.824 2.852 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O)c1ccc(C)cc1 19954502 YIQIQWQDYVKWSW-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB Cc1ccc(N2C(=O)/C(=C\NNC(=O)C3CC3)c3ccccc3C2=O)cc1 46341552 KSZDBVIYAIOHNT-PDGQHHTCSA-N 361.401 2.554 50 40 FFGB Cn1cccc1C(=O)NNC(=O)c1csc(-c2ccc(Cl)cc2)n1 12945567 HCENNDGTERHNEZ-UHFFFAOYSA-N 360.826 2.877 50 40 FFGB COc1cc(/C=N\NC(=O)c2ccccc2)ccc1OCC(=O)OC(C)C 408601874 LVSQVYGNLGRATJ-MTJSOVHGSA-N 370.405 2.790 50 40 FFGB Cc1cc([N+](=O)[O-])cc(C)c1OCC(=O)N/N=C/c1ccc(N(C)C)cc1 3212254 JXRJRNRHVWELPK-RGVLZGJSSA-N 370.409 2.807 50 40 FFGB C/C(=N\NC(=O)CCC(=O)N/N=C(\C)c1ccccc1)c1ccccc1 5369988 PQRQNFMPMZRTLJ-YHARCJFQSA-N 350.422 2.847 50 40 FFGB Cc1ccccc1C(=O)N/N=C1\C(=O)Nc2ccc(Br)cc21 6056055 LCJRSVWENJCWFC-UHFFFAOYSA-N 358.195 2.844 50 40 FFGB CC(=O)/C(C#N)=C1/NC(=O)[C@H](Cc2ccc(Br)cc2)S1 13687708 GZAPPVNNNJMCJQ-PBBNAPBQSA-N 351.225 2.547 50 40 FFGB Cc1ccc(N2C(=O)[C@@H]3SC(N)=C(C#N)[C@@H](c4ccco4)[C@@H]3C2=O)cc1 101304595 GHPDSTAHLAOERL-HRCADAONSA-N 365.414 2.671 50 40 FFGB COc1ccc(OC)c([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)c1 2502527 QHDMMOKFGGHDSG-SFHVURJKSA-N 352.346 2.651 50 40 FFGB CCOc1cc(/C=N/NC(=O)Cc2cccs2)ccc1OCCOC 6961161 DTMYDVXJMGUNAT-CPNJWEJPSA-N 362.451 2.865 50 40 FFGB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@@H]1C[C@H]1c1ccccc1 4729471 XQCBUEOBLUJVME-VESHTZQJSA-N 351.362 2.559 50 40 FFGB C#CCOc1ccc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)cc1 409332312 GQSJCWSVLOOOEL-STZFKDTASA-N 352.390 2.870 50 40 FFGB CCOC(=O)COc1ccc(Br)cc1/C=C(\C#N)C(N)=S 33422716 JPLGDJKYZLBSGT-BJMVGYQFSA-N 369.240 2.584 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1ccc(Br)cc1 886536 FESFAAXDSQDEFW-UHFFFAOYSA-N 364.268 2.758 50 40 FFGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccccc2C(=O)O)cc1 59444362 SUQQVAAXWUVWGW-RGVLZGJSSA-N 353.378 2.597 50 40 FFGB COc1cccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)c1OC 2726727 WBPWLQOQCRHHOP-JLHYYAGUSA-N 352.346 2.948 50 40 FFGB CCc1c(C(=O)NNC(=O)[C@@H]2CC(C)=C(C)C[C@@H]2C(=O)O)csc1C 2765297 ZQPZNPVQFAMIRN-KGLIPLIRSA-N 364.467 2.827 50 40 FFGB N#C/C(=C\c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)NC[C@H]1CCCO1 2801110 JBUXZQQMDPGZLM-IUYQLWOBSA-N 366.373 2.847 50 40 FFGB COc1cccc(/C=N/NC(=O)c2cc3c(OC)c(OC)ccc3[nH]2)c1O 2347722 LBDAKCZKPFESHE-KEBDBYFISA-N 369.377 2.663 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)Cc1ccc(CC)cc1 409361281 CAJJFSYKNDPKKS-STZFKDTASA-N 365.389 2.862 50 40 FFGB Cc1c(NC(=O)/C(C#N)=C\c2cccc(O)c2)c(=O)n(-c2ccccc2)n1C 33432038 DEICYEQWXYVFKW-WJDWOHSUSA-N 374.400 2.736 50 40 FFGB N#CCCn1cc(/C=N/NC(=O)c2ccncc2)c(-c2ccc(F)cc2)n1 3166703 OHQOFWOXOGJIKY-FSJBWODESA-N 362.368 2.762 50 40 FFGB O=C(Oc1cccc(/C=N/NC(=O)[C@@H](O)c2ccccc2)c1)c1ccco1 1425013 IAQPIFFLKUNVEF-LANLRWRYSA-N 364.357 2.683 50 40 FFGB COc1ccc(NCC(=O)N/N=C(\C)c2cccc(NC(C)=O)c2)cc1 5119796 IRFQUECGTFCGTC-LPYMAVHISA-N 354.410 2.606 50 40 FFGB COc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)NCc2cccnc2)cc1 5728333 UKANTHYBUHRSNU-CXUHLZMHSA-N 359.389 2.704 50 40 FFGB CCC/C(=N\NC(=O)Cc1csc(N2CCOCC2)n1)c1ccccc1 4964887 TYQXGZQTDMJADN-HEHNFIMWSA-N 372.494 2.843 50 40 FFGB C=CCOC(=O)C1=C(C)NC(S)=C(C#N)[C@H]1c1ccc(C(=O)OC)cc1 19851947 XIOWSNNOBDJWLX-MRXNPFEDSA-N 370.430 2.828 50 40 FFGB COC(=O)COc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc1 216040131 PMPDHACIHCCHID-MTJSOVHGSA-N 354.406 2.548 50 40 FFGB CC1=C(C(=O)c2ccccc2)[C@@]2(C(=O)N(C)c3ccccc32)C(C#N)=C(N)O1 49947130 LRXFBKHSEDTVFX-QFIPXVFZSA-N 371.396 2.782 50 40 FFGB COc1cc(/C=N/NC(=O)CNc2ccc(C)cc2)cc(OC)c1OC 1215993 VNYMPTFYYACPND-SRZZPIQSSA-N 357.410 2.583 50 40 FFGB CC(=O)Nc1sc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)c(C)c1C#N 408721126 CYUJLUABVXOGGS-QGMBQPNBSA-N 371.378 2.559 50 40 FFGB CC(C)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(O)c3)[C@@H]2C1 4452843 PBMOQROQJMANGG-MOPGFXCFSA-N 359.433 2.526 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2ccc(OC)cc2OC)cc1OC 6657076 YOXSYPMKEIBQOJ-UDWIEESQSA-N 358.394 2.875 50 40 FFGB CCCCOC[C@@H](CCl)OC(=O)NS(=O)(=O)c1ccc(C)cc1 16639077 WPIOQNRMSASMIS-CYBMUJFWSA-N 363.863 2.834 50 40 FFGB CCOC(=O)/C(C#N)=C\c1cn(CCC(=O)O)nc1-c1ccc(F)cc1 6179692 QLVMVYOBDWPPDU-LCYFTJDESA-N 357.341 2.634 50 40 FFGB O=C(NNC(=O)c1ccccc1C(=O)c1ccccc1)c1ccccc1O 13011709 NDGROURZJNTECE-UHFFFAOYSA-N 360.369 2.698 50 40 FFGB O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccc2c(c1)OCO2 8707229 GLQBACHNGMMKAC-UHFFFAOYSA-N 368.320 2.889 50 40 FFGB COC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](Cl)c1ccccc1 3851682 CWMHUPHLHLCPCS-HOTGVXAUSA-N 367.854 2.795 50 40 FFGB biogenic O=C(N/N=C\c1ccccc1Cl)C(=O)N/N=C/c1ccccc1Cl 17313436 PSIWOLQLWQMIME-KFSYKRRRSA-N 363.204 2.594 50 40 FFGB COc1ccc(C(=O)NNC(=O)/C=C/c2ccco2)cc1Br 955304 MQHMXNBLRARALD-FNORWQNLSA-N 365.183 2.525 50 40 FFGB O=C(O)c1ccccc1/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1 1698002 OHEXNWMUKGPOCU-HZHRSRAPSA-N 374.396 2.771 50 40 FFGB Cc1ccc(S(=O)(=O)/C(C#N)=C/N2CCN(c3ccccc3)CC2)cc1 2504469 FIRFEZICMAFISK-CAPFRKAQSA-N 367.474 2.956 50 40 FFGB CCOc1ccccc1N1C[C@H](C(=O)Oc2ccc([N+](=O)[O-])cc2)CC1=O 7929361 JRGKIDCPIJHNQL-CYBMUJFWSA-N 370.361 2.952 50 40 FFGB CC(C)N1CCC(=NNC(=O)c2cc(Br)ccc2O)CC1 55008977 PFPYLTCRRUGOPG-UHFFFAOYSA-N 354.248 2.745 50 40 FFGB COc1ccc2c3c1O[C@@H]1[C@H](Br)C=C[C@@H]4[C@H](C2)N(C)CC[C@@]341 103844487 HUJIUABKBDAGKG-HXHAXSGFSA-N 362.267 2.904 50 40 FFGB CCCOc1ccc(C(=O)CCC(=O)NNC(=O)c2cccs2)cc1 6942290 WCXRCPMMHSAOKF-UHFFFAOYSA-N 360.435 2.961 50 40 FFGB O=C(NNC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1ccoc1 16227143 MMRYXWQTUISODL-UHFFFAOYSA-N 358.357 2.965 50 40 FFGB CN(C)c1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)o1 408791289 YHFBXFFLDQIHCP-PEZBUJJGSA-N 350.422 2.601 50 40 FFGB CCCc1n[nH]c2c1[C@@H](c1ccc(OC)c(OCC)c1)C(C#N)=C(N)O2 5123847 PHPKNLYLCWLWRV-INIZCTEOSA-N 354.410 2.988 50 40 FFGB OC[C@H](I)C[C@](F)(OC(F)(F)F)C(F)(F)F 4290064 KPABQJYHRYTITM-DMTCNVIQSA-N 370.002 2.937 50 40 FFGB CCN(CC)C(=O)CSC1=C(C#N)[C@H](c2ccc(OC)cc2)CC(=O)N1 6325187 JNBDCVDQKMGHGB-HNNXBMFYSA-N 373.478 2.635 50 40 FFGB CCc1cccc(CC)c1NC(=O)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 7782523 OGYQVJUVKLLPPR-UDWIEESQSA-N 368.393 2.808 50 40 FFGB COc1ccc(OCC(=O)N/N=C(\C)CC(=O)Nc2ccc(F)cc2)cc1 100927694 HXNCUVDWHROHQH-LPYMAVHISA-N 373.384 2.734 50 40 FFGB O=C(NNC(=O)c1ccnc2ccccc12)Nc1ccc([N+](=O)[O-])cc1 26780118 OIRBFBHOMDNVCU-UHFFFAOYSA-N 351.322 2.610 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1cnn(Cc2ccccc2Cl)c1 17699253 ZZSXYIJAIMHLSI-CXUHLZMHSA-N 358.829 2.644 50 40 FFGB Nc1nnc(CC(=O)N/N=C\c2ccc(-c3cccc(Cl)c3)o2)s1 4857569 RKAIUKZAFUSTGF-LSCVHKIXSA-N 361.814 2.727 50 40 FFGB Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)c(C)c1 15519981 MXGBKHLHNLEACQ-UHFFFAOYSA-N 371.462 2.727 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1O 408959974 BIAXHTMXWGYOFG-GIJQJNRQSA-N 355.306 2.819 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(OC)c1 33671218 UTCUIRVNDJJSTG-UFWORHAWSA-N 362.769 2.850 50 40 FFGB N#CC1=C(N)N(c2nc[nH]n2)C2=C(C(=O)CCC2)[C@@H]1c1cccc(Cl)c1 5447822 ZFYCAXDCKHUFBQ-OAHLLOKOSA-N 366.812 2.763 50 40 FFGB O=C(N[C@]1(C(Cl)Cl)NC(c2ccccc2)=NC1=O)c1cccs1 1775975736 FLBQIEFSHINMMQ-HNNXBMFYSA-N 368.245 2.555 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2ccc(Br)cc2)cc1 1497079 XMTGKEKIYCPHRF-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB CCOC(=O)C1=CS/C(=C(/C#N)C(=O)OCC)N1c1ccc(OC)cc1 6242198 ZTKMISVZMYRRKV-PEZBUJJGSA-N 374.418 2.951 50 40 FFGB COc1cc(Br)ccc1OCC(=O)N/N=C/c1ccccc1 1433701 ZJYOVTAPFPYOTA-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3ccccc3)CC2=O)cc1 6962940 OSXCZSSANVCLIM-WMRWHDLOSA-N 351.406 2.589 50 40 FFGB CCn1nc(C(=O)N/N=C2/CCCc3ccccc32)c2ccccc2c1=O 57420347 BGZGMSGRMFVQIS-PYCFMQQDSA-N 360.417 2.887 50 40 FFGB O=C(NNC(=O)[C@H]1CCOC1)c1ccc(COc2ccc(Cl)cc2)cc1 58412924 ONIPERYHIFQPAN-HNNXBMFYSA-N 374.824 2.717 50 40 FFGB CC(C)(C)c1ccc(OCC(=O)NNC(=O)c2ccccc2C(=O)O)cc1 4393983 JGSSVACHCVMMQH-UHFFFAOYSA-N 370.405 2.522 50 40 FFGB Cc1ccc(C)c(S(=O)(=O)NNC(=O)c2oc3ccccc3c2C)c1 7380364 VVMBZKBAIKCXPD-UHFFFAOYSA-N 358.419 2.981 50 40 FFGB Cc1ccc(SCCC(=O)N/N=C2/C(=O)N(C)c3ccccc32)cc1 409340199 SCWDCVPRZDBXIR-DYTRJAOYSA-N 353.447 2.974 50 40 FFGB Cc1ccc2[nH]c(=O)cc(C(=O)N/N=C/c3ccccc3[N+](=O)[O-])c2c1 28629033 GYPLUCNUGNXCBW-VXLYETTFSA-N 350.334 2.509 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc(Cl)c1OC 13137314 RQPYVWAYRZYMRG-WTWVRAIASA-N 364.829 2.949 50 40 FFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1cccc(O)c1)c1ccccc1 408976227 ABIQKJXGUOQAES-NNIWKIFQSA-N 355.394 2.720 50 40 FFGB CCSC1=C(C#N)[C@H](c2ccccc2Cl)[C@@H](C(=O)OC)C(=O)N1 9317109 YOYYWBVGEURTTI-QWHCGFSZSA-N 350.827 2.831 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccccc2)c(OC)c1 14922832 MVIXSDDKGYDEFC-FYJGNVAPSA-N 355.394 2.838 50 40 FFGB Cc1cc(N(CCCl)CCCl)ccc1/C=N/C(C#N)=C(\N)C#N 104228763 ZHANMIIOHWTZAR-FMNSIQOVSA-N 350.253 2.915 50 40 FFGB COC(=O)c1ccc(Cl)cc1N/C=C(\C#N)C(=O)NCc1ccco1 9184259 NIJVNBLZDVPKHS-PKNBQFBNSA-N 359.769 2.855 50 40 FFGB Cc1ccc(-c2ccc(/C=C(\C#N)C(=O)N3CCOCC3)o2)c([N+](=O)[O-])c1 409217065 REAMXUFLBVGZNX-SDNWHVSQSA-N 367.361 2.929 50 40 FFGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2O)o1)c1ccncc1 408723201 PNFSIPGJEBDUAI-VXLYETTFSA-N 352.306 2.719 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])n1 8336637 HLYNOSGQJCQAJV-JXGVBEJFSA-N 371.422 2.909 50 40 FFGB Cc1ccc(C)c(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)c1 102612213 ISDLBGMHZQLDRI-YQBXUVTMSA-N 364.239 2.813 50 40 FFGB Cc1cc(N)nc(SCC(=O)/C(C#N)=C2/Nc3ccccc3S2)n1 103056883 IIRARYJDYARZIB-GDNBJRDFSA-N 355.448 2.981 50 40 FFGB Cn1c(SCC(=O)N/N=C/c2ccc(F)cc2)nnc1-c1ccccc1 2317572 JHIBWVYOAJYSNB-RGVLZGJSSA-N 369.425 2.864 50 40 FFGB O=C1Nc2ccccc2/C1=N/NC(=O)c1cc(-c2ccc(Cl)s2)n[nH]1 5093123 OPMMGFKLHCFQGF-UHFFFAOYSA-N 371.809 2.878 50 40 FFGB Cc1c(C(=O)NNS(=O)(=O)c2ccc(F)c(F)c2)oc2ccccc12 7380339 BWXSQHCZWCSFOM-UHFFFAOYSA-N 366.345 2.643 50 40 FFGB CC[C@@H](C)C(=O)NNC(=O)C1(c2cccc(C(F)(F)F)c2)CCOCC1 71921871 DMYHXKXVWOYUII-GFCCVEGCSA-N 372.387 2.947 50 40 FFGB CNC(=O)/C(C#N)=C/c1ccc(OCC(=O)N[C@@H](C)c2ccccc2)cc1 408792221 JRGCLBXGMSGLMD-BRFSQIRFSA-N 363.417 2.596 50 40 FFGB O=C(N/N=C/c1ccc2c(c1)OCCO2)c1ccc(N2CCCC2)cc1 7385720 WHVNQTKDBPUXFR-KGENOOAVSA-N 351.406 2.822 50 40 FFGB O=C(CSc1nc2ccccc2o1)N/N=C/c1ccc2c(c1)OCO2 716836 OWXOGKKUISABLG-QGMBQPNBSA-N 355.375 2.799 50 40 FFGB Cn1cc(/C=C/C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 12974270 DSOXULADFHVORB-GORDUTHDSA-N 355.276 2.504 50 40 FFGB O=C(N/N=C\c1cccc([N+](=O)[O-])c1O)c1ccc(-n2cccc2)cc1 409069020 VHVNRMVYBWBRCT-UNOMPAQXSA-N 350.334 2.855 50 40 FFGB CCn1ncc(/C=N/NC(=O)c2ccc(Cn3nc(C)cc3C)cc2)c1F 252484655 GCYPCTUHWSCYAI-UFFVCSGVSA-N 368.416 2.668 50 40 FFGB COc1ccc(N2CCN(C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 95567932 TULVXRNEEQWFGU-UHFFFAOYSA-N 357.366 2.924 50 40 FFGB CCOc1ccc(C(=O)N/N=C/c2cc(OC)c(OC)c(OC)c2)cc1 727619 YHPBGTJWESFKHN-UDWIEESQSA-N 358.394 2.875 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1 3058097 YDOKGGIQILMQFP-KGENOOAVSA-N 353.422 2.584 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)c1 59515515 MKCMSRNFBRJFCY-CIAFOILYSA-N 369.421 2.916 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1ccccc1 3364378 VNKAECXZPALMMH-UHFFFAOYSA-N 350.827 2.902 50 40 FFGB C[C@H](C(=O)NN=C1CCCCCC1)N(c1ccccc1)S(C)(=O)=O 408923195 GDHIQYMSBUJNLK-CQSZACIVSA-N 351.472 2.668 50 40 FFGB N#C/C(=C\c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1)C(=O)NC(N)=O 409242318 WVAPZIFZNODNAP-WEVVVXLNSA-N 360.713 2.610 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC2CCCC2)c(C)n1-c1ccc(F)cc1 408969601 QNAPWVNIVPMLQS-WSDLNYQXSA-N 370.428 2.742 50 40 FFGB O=C(NN=C1CCN(c2ccc(F)cc2)CC1)[C@@H]1COc2ccccc2O1 60418444 SYUHIHFSWSWVOP-IBGZPJMESA-N 369.396 2.738 50 40 FFGB O=C(CCl)N(c1cccc(Cl)c1Cl)[C@H]1CCS(=O)(=O)C1 40177627 BGHBFIFIGBEWBD-QMMMGPOBSA-N 356.658 2.752 50 40 FFGB COc1cc(/C=N/NC(=O)c2c[nH]c3ccccc23)c(OC)c(OC)c1 2751809 JWNMZMZODPMVKZ-UFFVCSGVSA-N 353.378 2.958 50 40 FFGB O=C(NNC(=O)c1c[nH]nc1-c1ccccc1)c1ccccc1-n1cccc1 12538561 RDQXRMNFZNIFOZ-UHFFFAOYSA-N 371.400 2.942 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 59151745 ZHENDGNVEXHLQS-RQZCQDPDSA-N 362.729 2.849 50 40 FFGB O=C(N/N=C/c1ccc(Cl)cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 5072199 YQIILPSCWZGLAS-WVISFHDSSA-N 359.788 2.982 50 40 FFGB CCCCOc1ccc(/C=N/NC(=O)C(=O)NCCc2ccccc2)cc1 5420536 CNXMBPKTZAEVGE-XQNSMLJCSA-N 367.449 2.675 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C/c1ccc(OCc2ccc(C)cc2)cc1 3089087 VLSJGFMUDRCRLY-OEAKJJBVSA-N 365.433 2.716 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)COc2ccccc2)c1 4036611 YQLLWJSJPTYLKF-UHFFFAOYSA-N 356.422 2.724 50 40 FFGB COc1ccccc1[C@H]1[C@@H](C(=O)C2CC2)N2C=C(C#N)C=C[C@@H]2C1(C#N)C#N 4729608 VTGZRMNOOGIDGF-AABGKKOBSA-N 370.412 2.822 50 40 FFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1c(O)cccc1O 84064702 DLTOGPVDXROYOF-UHFFFAOYSA-N 369.402 2.605 50 40 FFGB COC(=O)/C(C#N)=C/c1c(Oc2cccc(C)c2)nc2ccccn2c1=O 4205397 NQXJKJVKAFPXQC-SDNWHVSQSA-N 361.357 2.875 50 40 FFGB CCN(CC)c1ccc([C@H]2C(C#N)=C(O)NC(=O)[C@@H]2[n+]2ccccc2)cc1 4561441 ZAGUSYJLZUEAIH-RBUKOAKNSA-O 363.441 2.568 50 40 FFGB O=C(NNS(=O)(=O)c1ccccc1F)c1cc2c(s1)CCCCC2 7404818 GISVKGSTHNHXKV-UHFFFAOYSA-N 368.455 2.779 50 40 FFGB O=C(CSc1nc(C2CC2)nc2ccccc12)NNC(=O)c1ccco1 9336115 LZHCVVJIBRRJRS-UHFFFAOYSA-N 368.418 2.654 50 40 FFGB C[C@H](Oc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1)C(=O)O 33340230 GBZPMFWSRLXMCJ-FMNVXAMXSA-N 350.374 2.762 50 40 FFGB CCSC1=C(C#N)[C@H](c2ccccc2[N+](=O)[O-])[C@H](C(=O)OC)C(O)=N1 841867 OWZPJQRAKBMHDO-STQMWFEESA-N 361.379 2.926 50 40 FFGB COc1cccc2c1NC(=O)/C2=N\NC(=O)c1ccc(Br)cc1 59472661 IGFURPCBNSYVGD-UHFFFAOYSA-N 374.194 2.544 50 40 FFGB O=C(CN1C[C@H](c2ccccc2)CC1=O)N/N=C/c1cc(Cl)ccc1O 106648660 OLKOUUIWBYPKTR-SBUZPKSBSA-N 371.824 2.512 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2C)cc1 59516009 NXXDPPYSYBCQFJ-FYJGNVAPSA-N 351.406 2.957 50 40 FFGB O=C(Cc1csc(-c2cccc(Cl)c2)n1)NNC(=O)c1ccccn1 12971888 VSQGDXBIGSAEHL-UHFFFAOYSA-N 372.837 2.862 50 40 FFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc(F)cc3)CC2=O)cc1 6962928 AKQXKMXGBMXQTA-HJGVYBFFSA-N 369.396 2.728 50 40 FFGB CC(C)N1CCC(=NNC(=O)C(O)(c2ccccc2)c2ccccc2)CC1 55080783 GWSHVRJQKXKZPL-UHFFFAOYSA-N 365.477 2.899 50 40 FFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\NNC(=O)c1ccccc1O 100994412 BAASRKVKEAQJER-BOPFTXTBSA-N 364.405 2.550 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccccc2OCC(=O)O)cc1 7168151 UUBJFBYIJHFBRA-GXDHUFHOSA-N 352.346 2.704 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nc(C)cs1 7195684 CLPNCVSKMMUCOW-UHFFFAOYSA-N 371.871 2.667 50 40 FFGB COC(=O)COc1cccc(/C=N/NC(=O)CSc2ccc(C)cc2)c1 408880219 GQRPWOGKDYUKOO-RGVLZGJSSA-N 372.446 2.789 50 40 FFGB Cc1ccc(S(=O)(=O)OCC[C@@H](CCBr)C(=O)O)cc1 642882611 RZOQDVDRUPBAGU-LLVKDONJSA-N 365.245 2.576 50 40 FFGB CCOc1ccccc1OCC(=O)NNC(=O)Cc1ccc(Cl)cc1 12787508 WKSJEUVILYOHQU-UHFFFAOYSA-N 362.813 2.508 50 40 FFGB Cc1c(NC(=O)/C(C#N)=C\c2ccc(O)cc2)c(=O)n(-c2ccccc2)n1C 4844238 CCPXARZAKKLKAX-VBKFSLOCSA-N 374.400 2.736 50 40 FFGB CC(=O)n1cc(/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 4907254 LTYXVUSTKKHCJU-GRSHGNNSSA-N 350.334 2.974 50 40 FFGB N#CC1=C(N)Oc2c(oc(CO)cc2=O)[C@@H]1c1c(Cl)cccc1Cl 664087 XCNYOTDRZOZTQK-LBPRGKRZSA-N 365.172 2.657 50 40 FFGB Nc1nnc(CC(=O)N/N=C/c2ccc(-c3ccccc3Cl)o2)s1 1259076 BCZFTXPAADWHHR-QGMBQPNBSA-N 361.814 2.727 50 40 FFGB C/C(=C\C(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1cccnc1 101153755 FDUFLKYKEKIYCE-FNORWQNLSA-N 373.228 2.622 50 40 FFGB O=C(N/N=C/c1cc(Br)cc(Cl)c1O)c1cccnc1 3101623 YLEUZMGRXKAQIP-REZTVBANSA-N 354.591 2.967 50 40 FFGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@H]2c1ccc2c(c1)OCO2 5267587 JFKAUSOXDDDCGT-AWEZNQCLSA-N 370.386 2.790 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1[N+](=O)[O-] 408543764 SWEIYYSFTJVGLT-QPEQYQDCSA-N 367.317 2.847 50 40 FFGB Cc1occc1C(=O)NNC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1 48301757 ACIOBNILDWZGEG-NSHDSACASA-N 370.409 2.642 50 40 FFGB Cc1cc(N(CCCl)CCCl)ccc1/C=N/C(C#N)=C(/N)C#N 1582175 ZHANMIIOHWTZAR-XETXUVPDSA-N 350.253 2.915 50 40 FFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc(C)cc3)CC2=O)cc1 6962974 JIGKMVDIRDPREB-KOWBDXASSA-N 365.433 2.897 50 40 FFGB CCn1c(NNC(=O)c2cc(-c3ccccc3)[nH]n2)nc2ccccc2c1=O 10322818 WORQMBDNHGLFAW-UHFFFAOYSA-N 374.404 2.563 50 40 FFGB O=C(N/N=C/c1ccccc1Cl)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O 3465888 NVCQRUFQDALLKZ-FRKPEAEDSA-N 364.701 2.626 50 40 FFGB Cc1cccc(C)c1OCC(=O)NNC(=O)c1ccc(OC(C)C)cc1 8563150 VYLJSRHWSSQIRI-UHFFFAOYSA-N 356.422 2.931 50 40 FFGB COC(=O)c1ccc(N/C=C(\C#N)S(=O)(=O)c2ccc(OC)cc2)cc1 18031063 XOMBOISORJRTEC-SFQUDFHCSA-N 372.402 2.733 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)cc1 408866982 IGUSFUQPLIOIML-OLPVWXKPSA-N 358.438 2.905 50 40 FFGB COc1ccc(CC(=O)N/N=C\c2ccc(C)c([N+](=O)[O-])c2)cc1OC 409365013 PQLWTMHXDGNEKG-ODLFYWEKSA-N 357.366 2.613 50 40 FFGB N#C/C(=C/c1cccc(OCC(N)=O)c1)C(=O)Nc1ccccc1Cl 409227926 XMUQLADTXAIIDT-JYRVWZFOSA-N 355.781 2.750 50 40 FFGB N#C/C(=C\c1cn(CC(=O)O)c2ccccc12)C(=O)NCc1ccccc1 4678033 NCHHUUVWLNYFHK-MHWRWJLKSA-N 359.385 2.949 50 40 FFGB COc1cccc(/C=C(/C#N)C(=O)NC2CCCCC2)c1O[C@@H](C)C(=O)O 409246357 BMWVKNRVUCFHGE-WZMONFQBSA-N 372.421 2.903 50 40 FFGB C[C@@H](Br)C(=O)NC[C@H](O[C@@H]1CCOC1)c1cccc(F)c1 95097931 VHPHYPYBRHIIEX-HONMWMINSA-N 360.223 2.572 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(Br)o2)cc1OC 1457947 KZRRSIINQJWXIV-LZYBPNLTSA-N 353.172 2.823 50 40 FFGB COc1cc2c(cc1[C@@H]1C(C#N)=C(N)OC3=C1C(=O)CC(C)(C)C3)OCO2 818648 UPKPRMWZTTVUFR-QGZVFWFLSA-N 368.389 2.875 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)[C@H]1C[C@H]1c1ccccc1 872289 HCSOFUOFDZTDKE-HOTGVXAUSA-N 358.825 2.978 50 40 FFGB CSc1ccc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2)cc1 59444302 NJSRZZXIGJLQMD-RGVLZGJSSA-N 361.854 2.828 50 40 FFGB CCOc1cc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)ccc1O 409314223 QOTIOBZUYKVRAA-NDENLUEZSA-N 358.394 2.962 50 40 FFGB COC(=O)C1=C(C(=O)c2cccs2)[C@H](c2ccccc2)C(C#N)=C(N)O1 85408957 BOVXRMZBVPJVKO-CQSZACIVSA-N 366.398 2.866 50 40 FFGB O=C(OCCl)O[C@H]1c2nccnc2C(=O)N1c1ccc(Cl)cn1 22054716 LTLOOQRIMYDJAP-LBPRGKRZSA-N 355.137 2.534 50 40 FFGB in-vitro N#CC1=C(N)Oc2c(ccc3cc(O)ccc23)[C@@]12C(=O)Nc1ccccc12 36649124 UIMUWFCUHSHMKD-OAQYLSRUSA-N 355.353 2.870 50 40 FFGB COc1cc(Br)ccc1OCC(=O)N/N=C/c1ccco1 1433725 WWYLDYHLOIQNHA-LZYBPNLTSA-N 353.172 2.580 50 40 FFGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)COc1ccccc1Cl 216748044 YRGOJZBMPZPFAB-UHFFFAOYSA-N 357.797 2.926 50 40 FFGB COc1cc(C)ccc1C(=O)N/N=C/c1cc(OC)c(OC)c(OC)c1 657957 YCUORKWRNMKSDN-RGVLZGJSSA-N 358.394 2.793 50 40 FFGB Cc1ccccc1C(=O)NNC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 50095731 GSMOUCSMVSCEEU-QGZVFWFLSA-N 357.385 2.562 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccc([N+](=O)[O-])o1 999306 JDGBLHAEFVTTDT-CYBMUJFWSA-N 351.274 2.512 50 40 FFGB CCCOc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)OC)cc2)cc1 20197295 JAHVSVZXFPSATO-FYJGNVAPSA-N 370.405 2.791 50 40 FFGB CC(C)(C)c1ccc(OCC(=O)NNC(=O)COc2ccccc2)cc1 4698779 RRELRCSFRPIFFE-UHFFFAOYSA-N 356.422 2.589 50 40 FFGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccccc1 7383424 VAYNBKBNXDIBFW-AWEZNQCLSA-N 370.430 2.617 50 40 FFGB O[C@@H]1[C@H]2[C@H]3C[C@H]4[C@H]5[C@@H]3[C@H]1[C@](c1ccccc1)([C@H]24)[C@@H]5I 245264226 CDNDXHOZUAFLPN-QSRWVCFCSA-N 364.226 2.860 50 40 FFGB O=C(CCc1ccccc1)N/N=C1/C(=O)Nc2ccc(Br)cc21 12586516 ZCYIVJWWUWEBRE-UHFFFAOYSA-N 372.222 2.854 50 40 FFGB C/C(=N\NC(=O)c1cc(Br)ccc1O)c1ccc(O)cc1O 4751085 OCQUZHNWZRJUOZ-CAOOACKPSA-N 365.183 2.720 50 40 FFGB CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 58883510 PJTCRDKDAGMQKI-UDWIEESQSA-N 368.393 2.981 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl 3031282 RIQBKSWFBZVNJF-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB O=C(N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O)c1ccccc1 3100153 NOCLBNOITLMAKE-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB COc1cccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1 58915696 MBOZWEYPRUQFSE-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB O=C(CSc1nc(-c2ccc(F)cc2)c[nH]1)NNC(=O)c1ccccc1 9156561 HWYGIGZKIYQRHT-UHFFFAOYSA-N 370.409 2.769 50 40 FFGB O=C(COc1cccc(Br)c1)NNC(=O)CC1CCCC1 12861100 NQCPIIKSCLMZCE-UHFFFAOYSA-N 355.232 2.556 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc(Cl)c1O 13096676 XZSPSGDCAYBJRT-XEVNVYFWSA-N 350.802 2.646 50 40 FFGB C/C(=N\NC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O)c1ccccc1 408775587 IJTHFIHQSWQQGZ-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)c2oc3ccccc3c2C)cc1C 7380369 YYHMVXOHCZZHDY-UHFFFAOYSA-N 358.419 2.981 50 40 FFGB Cc1ccc(/C=N/NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)c(C)c1C 409116025 LDFMSNYMILNWCA-UDWIEESQSA-N 373.478 2.772 50 40 FFGB Cc1ccc2c(c1)[C@@H](N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](Cl)C(=O)O2 4974359 ADWQHMXRYKUWAT-USXIJHARSA-N 359.809 2.848 50 40 FFGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1 59515520 NMKQMCWFMQVGIP-RGVLZGJSSA-N 353.378 2.597 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2cccc(OC)c2O)cc1 59473771 RSQVTESNJMISCW-VXLYETTFSA-N 360.435 2.793 50 40 FFGB COc1ccccc1C(=O)NNC(=O)c1ccc(Br)s1 23156419 QLECXGNKMIGNPI-UHFFFAOYSA-N 355.213 2.594 50 40 FFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccccc1[N+](=O)[O-] 3081513 MEPIWPCSCLJFNB-RQZCQDPDSA-N 374.378 2.887 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OC)cc2OC)cc1 193794071 MLEOCIZVSBGNOX-YBEGLDIGSA-N 352.390 2.936 50 40 FFGB CC(=O)O[Si](OCc1ccccc1)(OCc1ccccc1)OC(C)=O 203589579 BKLZXRZFFSHLOS-UHFFFAOYSA-N 360.438 2.982 50 40 FFGB CC(C)OC(=O)COc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1 6327957 KKEOMSIULVSWRZ-FYJGNVAPSA-N 354.406 2.710 50 40 FFGB O=C(NNC(=O)C1CCCC1)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839332 FSYRVYXLOJTBLS-UHFFFAOYSA-N 373.840 2.501 50 40 FFGB C=CCn1c(SCC(=O)/C(C#N)=C(/C)N)nnc1-c1ccccc1OC 104775269 DGQWNMRJAACCCP-OWBHPGMISA-N 369.450 2.557 50 40 FFGB Cc1ccc(S(=O)(=O)n2cc(/C=C(\C#N)C(N)=O)c3ccccc32)cc1 3255598 LPGGXLDYODLKQP-GXDHUFHOSA-N 365.414 2.579 50 40 FFGB C/C(=N\NC(=O)CNC(=O)c1ccco1)c1ccc(Cl)c(Cl)c1 4807305 GZJBXAIKRPKTPD-DJKKODMXSA-N 354.193 2.857 50 40 FFGB CCOc1cc(/C=C(/C#N)C(N)=O)ccc1Oc1ccc([N+](=O)[O-])cn1 409202260 QGXKUYOVPLDSJB-GHXNOFRVSA-N 354.322 2.573 50 40 FFGB O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccc([N+](=O)[O-])cc1 409184837 IGFCPMAWUXKLIO-GIJQJNRQSA-N 357.391 2.853 50 40 FFGB O=C(N/N=C/c1cccc(OCc2ccccc2Cl)c1)C(=O)NC1CC1 8219735 JJNPIIUTROXHCX-SRZZPIQSSA-N 371.824 2.648 50 40 FFGB O=C(CNc1nc2ccccc2s1)NNC(=O)c1ccc(Cl)cc1 14112074 VPGBZIKLOSJHED-UHFFFAOYSA-N 360.826 2.823 50 40 FFGB CCOC(=O)N1CCC(=NNC(=O)c2cc3ccccc3cc2O)CC1 5444396 QWAYDDBUNALGAI-UHFFFAOYSA-N 355.394 2.884 50 40 FFGB C/C(=N\NC(=O)NCc1cccc(C(F)(F)F)c1)c1csc(N)n1 98055443 XWVLFOIOPGYZAO-ODCIPOBUSA-N 357.361 2.968 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCCC3)c2C)cc1 2053988 JHULVVHAKPZRMK-HYARGMPZSA-N 366.465 2.865 50 40 FFGB CCCC1=NN(c2ccccc2)C(=O)/C1=C(/C)NNC(=O)c1cccnc1 103918438 UFTJPACCKCMFMT-JXAWBTAJSA-N 363.421 2.793 50 40 FFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)c(OC)c1 59515390 GWPXWHQYYHMZQO-CIAFOILYSA-N 369.421 2.916 50 40 FFGB Cc1cc(Cl)ccc1N(CC(=O)NN=C1CCCCC1)S(C)(=O)=O 408789070 IWVAPECZWZQLFS-UHFFFAOYSA-N 371.890 2.851 50 40 FFGB CCc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@@H]4[C@@H](Br)[C@@H]2C[C@@H]43)cc1 408677504 BZUUVJPOVIVQMP-JNWWKETESA-N 364.239 2.759 50 40 FFGB Cn1c(SCC(=O)N/N=C/c2ccccc2F)nnc1-c1ccccc1 2319999 CQSWNLFOXXLRBU-RGVLZGJSSA-N 369.425 2.864 50 40 FFGB COc1cc(/C=N/NC(=O)CCC(=O)Nc2ccc(C)c(C)c2)ccc1O 6215637 GUYFJBLNXWDMKN-CIAFOILYSA-N 369.421 2.887 50 40 FFGB CN1C(=O)/C(=N\NC(=O)c2cccc(Br)c2)c2ccccc21 101098211 INNKKRJUOSULLJ-JXAWBTAJSA-N 358.195 2.560 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCc3ccccc32)c1 24748571 WHMOUQODVUUIHG-SFHVURJKSA-N 354.406 2.585 50 40 FFGB COC(=O)c1ccccc1C(=O)[C@H](Br)CBr 309509411 OCCVFUOTMRNFBW-SECBINFHSA-N 350.006 2.814 50 40 FFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccc(C)o2)c2ccccc21 409369774 WPUPDPXDGKIIIJ-KEBDBYFISA-N 353.378 2.870 50 40 FFGB Cc1nn(CC(=O)N/N=C/c2ccc(F)s2)c(C)c1Br 252509806 YWBIDHXWORXMHS-PJQLUOCWSA-N 359.224 2.613 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc2sc(=O)oc12 6380930 MESABKKYZOIEQT-CAOOACKPSA-N 373.346 2.535 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2)c(OC)c1 6180175 GTCSSZKTHDGBRC-LDADJPATSA-N 366.417 2.944 50 40 FFGB C[S@](=O)Cc1cccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1 21324026 NXKJCYPKLZYXLR-STAMENHASA-N 374.506 2.543 50 40 FFGB C/C(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)=N\c1ccc(C)cc1 102766148 KHAWEWRZFVNMNE-CPNJWEJPSA-N 354.366 2.847 50 40 FFGB COc1cc(/C=N/NC(=O)COc2cc(C)cc(C)c2)cc(OC)c1OC 5697689 GFYOXEGYFQPASU-SRZZPIQSSA-N 372.421 2.858 50 40 FFGB CCOCCCNC(=O)/C(C#N)=C\c1ccc(O)c(Br)c1 96663251 XWHSCCCYJGXJKS-WQLSENKSSA-N 353.216 2.604 50 40 FFGB CN(c1ccc(C(=O)NN=C2CCCCCCC2)cc1)S(C)(=O)=O 409121911 VTSHEYQYASRQLK-UHFFFAOYSA-N 351.472 2.913 50 40 FFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(C)cc1 408906146 AQJXCYGBNAZINN-SXZORUHJSA-N 353.422 2.803 50 40 FFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2cn(CC#N)c3ccccc23)c1 6158837 AHFYGWVVUNXPKO-WSDLNYQXSA-N 359.389 2.887 50 40 FFGB O=C(COc1cccc(Br)c1)N/N=C/C(=O)c1ccccc1 13136502 ATVJBTCFVXYWKM-VCHYOVAHSA-N 361.195 2.813 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)[C@H](OC)c2ccccc2)cc1OC 685647 WZBLCWUYENZSAS-XNHPLOEXSA-N 372.377 2.678 50 40 FFGB Cc1cn(-c2ccccc2)nc1/C=N/NC(=O)c1c(C)nc2ccccn12 642413 SCLYJSNZFJGHIP-CIAFOILYSA-N 358.405 2.901 50 40 FFGB Cc1nc2ccccn2c1C(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 3300664 ZYGVBJFETZBKMB-GIJQJNRQSA-N 357.757 2.968 50 40 FFGB O=C(NNC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc([N+](=O)[O-])cc1 4681047 YQOCQNOLBWVVAE-UHFFFAOYSA-N 358.741 2.804 50 40 FFGB CN(NC(=O)C(C)(C)CCl)c1cnn(-c2ccccc2)c(=O)c1Cl 2155098 QQYLNYFPHILDTL-UHFFFAOYSA-N 369.252 2.618 50 40 FFGB O=S1(=O)CCc2ccccc2[C@@H](Br)[C@@H]1Br 1653739 CBWQIAZOKMCABI-NXEZZACHSA-N 354.063 2.815 50 40 FFGB O=C(N/N=C/c1ccc(O)cc1)c1ccc(I)cc1 10476092 FYUHNGXKTLSFSZ-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1-n1cccc1 12533531 RFPPOLBYTYSIPA-UHFFFAOYSA-N 364.361 2.769 50 40 FFGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)CNC(=O)CCc1ccccc1 1819278 FSOUJEFKEBEKAY-YDZHTSKRSA-N 362.433 2.675 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)CNc2ccccc2)cc1[N+](=O)[O-] 409377558 IWGKLZOFYJPNEG-DEDYPNTBSA-N 356.382 2.946 50 40 FFGB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N/N=C1/C(=O)Nc2ccccc21 6130640 KLFBOLKFZSHOME-NSHDSACASA-N 357.797 2.888 50 40 FFGB CCOc1cc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])ccc1O 4775401 QIADMZMUQZCXTB-VXLYETTFSA-N 373.365 2.537 50 40 FFGB COC(=O)N/N=C/c1cc(Br)cc(Br)c1OC 7948158 AXNPXAUNFJGQJQ-WLRTZDKTSA-N 366.009 2.910 50 40 FFGB CCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OC(C)C)cc2)cc1 408718295 HRFOBMDXZKQPHT-FYJGNVAPSA-N 369.421 2.961 50 40 FFGB O=C(Cc1cccc2ccccc12)N/N=C1\C(=O)Nc2ccc([N+](=O)[O-])cc21 10843008 LIDVFHWCRZQIRH-UHFFFAOYSA-N 374.356 2.763 50 40 FFGB O=C(COc1cccc2cccnc12)N/N=C/c1ccc(N2CCCC2)o1 59138237 HMZBFHBRBBCHDJ-LPYMAVHISA-N 364.405 2.957 50 40 FFGB CC(=O)c1sc(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)nc1C 27516701 LBHWAUUFUNBQDC-UHFFFAOYSA-N 371.340 2.748 50 40 FFGB Cc1nn(-c2cccc(O)c2)c2c1[C@H](c1cccc(O)c1)C(C#N)=C(N)O2 59416590 BPDOZNUTORDFOL-GOSISDBHSA-N 360.373 2.810 50 40 FFGB C[C@H](Oc1ccc(/C=C(\C#N)C(=O)NCc2ccccc2)cc1)C(=O)O 2237651 GBZPMFWSRLXMCJ-MPMPPSQCSA-N 350.374 2.762 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1ccc(OC(F)F)cc1 8684130 RBKLBFGNTPRCLY-UHFFFAOYSA-N 351.378 2.597 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2cccc3c2OCCO3)cc1 6181897 ITQFMVNZFLCLEP-RGVLZGJSSA-N 372.446 2.850 50 40 FFGB COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O 40894341 GWCSSLSMGCFIFR-GWKPYITFSA-N 356.374 2.831 50 40 FFGB biogenic COc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)c([N+](=O)[O-])cc1OC 1090043 KNHUWRAENMYBRW-JWVDKRPRSA-N 361.398 2.888 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(OCC)c1 409351774 ZDDPWHDMHJMSHK-RGVLZGJSSA-N 356.378 2.977 50 40 FFGB Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(C=C(C#N)C#N)cc2)cc1 6508374 AAZNFAQZUNMKMK-UHFFFAOYSA-N 366.402 2.936 50 40 FFGB Cc1oc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1Br 408857718 LYEUHCVFDGZDLS-NOICUEDQSA-N 365.183 2.641 50 40 FFGB O=C(COc1cccc2ccccc12)N/N=C\c1ccc(O)c([N+](=O)[O-])c1 408963789 PIRWVNKXDOGEGF-JAIQZWGSSA-N 365.345 2.983 50 40 FFGB Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@H]3C[C@H]2[C@H]4Br)cc1 217424566 GIADFOWGSIJLCB-WZBKEBKWSA-N 350.212 2.505 50 40 FFGB O=C(N[C@]1(C(Cl)Cl)NC(c2cccs2)=NC1=O)c1ccccc1 97977259 VMMVQSDIMBIJHW-HNNXBMFYSA-N 368.245 2.555 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2cc(C(C)(C)C)n[nH]2)cc1[N+](=O)[O-] 5638683 GWOORYYTMKSSNK-VCHYOVAHSA-N 359.386 2.778 50 40 FFGB O=C(O)[C@H]1C[C@H](Sc2ccc([N+](=O)[O-])cc2)[C@@H](Cl)C[C@H]1C(=O)O 15079845 RMVAPMUOFNYPCC-RHYQMDGZSA-N 359.787 2.858 50 40 FFGB CCCCNC(=O)/C(C#N)=C\c1cc(Br)c(O)c(OC)c1 33361087 OMAWOVRSQMXETQ-WDZFZDKYSA-N 353.216 2.987 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCC1)c1ccccc1Cl 20209293 RTKVHHFQSWUUHX-UHFFFAOYSA-N 371.890 2.932 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccccn3)c2[C@H]1c1ccc([N+](=O)[O-])s1 4171075 GPPYLWPMYGXZCE-GFCCVEGCSA-N 366.362 2.660 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2cccc(C)c2)c1C 408944823 VRFWDQGRTJOOMQ-STCDJXRXSA-N 354.454 2.767 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCCO3)cc1OC 409366854 ZMXYWHCZWIRTGS-FYJGNVAPSA-N 370.405 2.558 50 40 FFGB CC(C)(C)c1ccc(C(=O)N/N=C/c2ccc(OCC(N)=O)cc2)cc1 15145851 JPSJYMYEMZQOMD-WSDLNYQXSA-N 353.422 2.612 50 40 FFGB CCn1c(NNC(=O)CCc2cccc(C)c2)nc2ccccc2c1=O 11164897 YEQJZYSJWCKRFJ-UHFFFAOYSA-N 350.422 2.801 50 40 FFGB O=C(NNC(=O)c1cccs1)N[C@H](c1ccccc1)c1ccccn1 29327869 IKXOASOBWOYZRC-MRXNPFEDSA-N 352.419 2.877 50 40 FFGB CCOC(=O)/C(C#N)=C/c1cccc(OS(=O)(=O)c2ccccc2)c1 59399072 WYNVERTYNFZAMQ-RVDMUPIBSA-N 357.387 2.924 50 40 FFGB COc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 20248429 KCOOIGCBLSATHR-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB C[C@]12CC[C@@H]([C@](Br)([N+](=O)[O-])C1=O)[C@@]2(C)CBr 101023796 QNOPRINAANCQME-NEPJDUFXSA-N 355.026 2.755 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(F)cc2)c1C 408936370 HXNXQVMYNHKODB-OVMKCGGTSA-N 358.417 2.598 50 40 FFGB NC(=O)N/N=C1\C(=O)N(CCOc2cccc3ccccc23)c2ccccc21 46085192 DICIJJDGRPYKGM-NMWGTECJSA-N 374.400 2.638 50 40 FFGB Cc1nnsc1C(=O)N/N=C(/CC(=O)c1cccs1)C(F)(F)F 5243135 FHTDNCJICUTQPT-MFOYZWKCSA-N 362.358 2.829 50 40 FFGB CCC(=O)NNC(=O)CSc1nc(CC)nc2sc(C)c(C)c12 4241041 NKSVQXBEKODUHP-UHFFFAOYSA-N 352.485 2.520 50 40 FFGB COC(=O)Cn1cc(/C=N/NC(=O)c2ccc(F)cc2)c2ccccc21 8812469 GCEJGWYSMYECGA-UFFVCSGVSA-N 353.353 2.717 50 40 FFGB O=C(COc1cccc2cccnc12)N/N=C/c1cccc([N+](=O)[O-])c1 59503464 BXMAPYVRYFPYJU-RGVLZGJSSA-N 350.334 2.672 50 40 FFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc(OC)c1OC 2288985 DFKOPXRKBDNAIH-KRWDZBQOSA-N 353.378 2.513 50 40 FFGB biogenic,in-vitro COc1ccc(/C(C)=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])cc1 13847820 SYBMPICKNAMCNS-CPNJWEJPSA-N 357.366 2.831 50 40 FFGB N#C/C(=C\c1ccc(OCC(N)=O)c(Cl)c1)C(=O)Nc1ccccc1 409220421 ZBXFQBSEAIIWJJ-MDWZMJQESA-N 355.781 2.750 50 40 FFGB C/C(CCc1ccccc1)=N\NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1 409131076 JOTFQHQOYRKENE-HMMYKYKNSA-N 373.478 2.821 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)[C@H](O)c2ccccc2)cc1[N+](=O)[O-] 409145386 OGMMJZKDWMAMQC-MIQLPHMESA-N 357.366 2.567 50 40 FFGB Nc1ccccc1C(=O)N/N=C\c1cc2c(cc1Br)OCO2 32116937 KYAMPLYWBJHEFE-WSVATBPTSA-N 362.183 2.524 50 40 FFGB Cc1ccc(NC(=O)C(=O)N/N=C\c2cc([N+](=O)[O-])ccc2Cl)cc1C 223153579 AXYFNTTWGJXGQL-OCKHKDLRSA-N 374.784 2.954 50 40 FFGB O=C(O)COc1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1 6367589 GCVBXKQWVCYTKV-FYJGNVAPSA-N 363.373 2.705 50 40 FFGB COCCCNC(=O)C(=O)N/N=C/c1c2ccccc2cc2ccccc12 5526497 HCZKOSNXPIGHIM-OEAKJJBVSA-N 363.417 2.596 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)Cc1ccc(C)c(C)c1 6438922 QSPPQTISQZCGMA-RGVLZGJSSA-N 371.393 2.922 50 40 FFGB Cc1nc(N2CCN(C(=O)CCCl)CC2)c2c(C)c(C)sc2n1 4218025 HYSTZJMXXNDLHV-UHFFFAOYSA-N 352.891 2.894 50 40 FFGB O=C(NNC(=O)N1CCN(c2cccc(Cl)c2)CC1)c1cccs1 12533790 NWYPMDDDAUZQHX-UHFFFAOYSA-N 364.858 2.578 50 40 FFGB CC(C)Oc1ccc(CCC(=O)NNC(=O)c2ccccc2C(=O)O)cc1 2373463 HTWXIOBABVZOKP-UHFFFAOYSA-N 370.405 2.566 50 40 FFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3cccs3)CC2)cc1 409007229 VSPYXNNYJVEONW-DEDYPNTBSA-N 371.462 2.759 50 40 FFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(F)cc1 408907707 OYBAWRJCCWNUSQ-VYVDHXHBSA-N 357.385 2.633 50 40 FFGB COc1cc(N/C=C2\C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)cc(OC)c1 9423716 IOYCBYSOMBJYEX-ZDLGFXPLSA-N 369.421 2.864 50 40 FFGB CC(C)(C)[Si](C)(C)OC[C@H]1CC[C@H](n2cnc3c(=O)[nH]cnc32)O1 195506183 UBDRNBJBRQIQCA-VXGBXAGGSA-N 350.495 2.819 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2cccc3cccnc23)cc1OC 3032628 VBKWVQQKOMKNPY-WSDLNYQXSA-N 365.389 2.781 50 40 FFGB Cc1cccc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1C 102612185 VEPIMNVKKALHAX-BFUSDRCBSA-N 364.239 2.813 50 40 FFGB NC(=O)COc1ccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)cc1 59445205 UKGZJYHHSJYMJI-DNTJNYDQSA-N 366.204 2.621 50 40 FFGB COc1ccc(OCC(=O)NNC(=O)c2ccc3ccccc3c2)cc1 986658 NDILUVPGFTVMMN-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB O=[N+]([O-])C1=C([N+](=O)[O-])[C@H](S[C@H]2[C@@H]3CC[C@H](C3)[C@H]2Br)C=C1 104100549 HSONDIAAORAILM-IKKWRGQYSA-N 361.217 2.985 50 40 FFGB CCOc1cc(C(=O)NNC(=O)c2ccccc2)cc(OCC)c1OCC 7766071 IOQOPCBEHPOBLB-UHFFFAOYSA-N 372.421 2.958 50 40 FFGB CCOc1ccc(CC(=O)N/N=C\c2ccc(OC)c([N+](=O)[O-])c2)cc1 408711825 MKVHHTTXZHXCIU-UNOMPAQXSA-N 357.366 2.695 50 40 FFGB CN1C(=O)[C@@]2(C(C#N)=C(N)Oc3c2ccc2cccnc32)c2ccccc21 524732462 FZMUMMBNOOMAQS-NRFANRHFSA-N 354.369 2.584 50 40 FFGB COc1ccc(C(=O)/C(C#N)=C/c2cnc(N3CCOCC3)s2)cc1 96315913 WBABOJXVSXCXPY-GXDHUFHOSA-N 355.419 2.778 50 40 FFGB CC(=O)NNC(=O)CSc1nc(C)c(C)n1[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 107329183 PFXSEEHHDLLQOM-OEAJRASXSA-N 364.515 2.757 50 40 FFGB N#C/C(=C/c1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCCO2)C(N)=O 3244331 WDXKBDHXMGPMNR-GDNBJRDFSA-N 372.384 2.703 50 40 FFGB COc1ccc(/C=N/NC(=O)CN2Cc3cc(C)c(C)cc3C2)c(OC)c1 409203828 ZSUWOMMBXRMZTM-LSHDLFTRSA-N 367.449 2.787 50 40 FFGB COc1ccc(/C=N\NC(=O)COc2cc(C)cc(C)c2)cc1[N+](=O)[O-] 30802439 ZGXRQOUEAOVGBX-GRSHGNNSSA-N 357.366 2.749 50 40 FFGB Cc1noc(-c2ccc(C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)n1 29506727 LYKGLBAQGLUPEN-UHFFFAOYSA-N 368.418 2.670 50 40 FFGB CCc1cc2c(SCC(=O)NNC(=O)c3ccccc3)ncnc2s1 2620021 NIQGZVXGLSODBX-UHFFFAOYSA-N 372.475 2.807 50 40 FFGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(OC(C)=O)cc2)cc1 59514909 LGNOECQEQYFNJC-UDWIEESQSA-N 353.378 2.724 50 40 FFGB COc1ccccc1[C@@H]1C(C#N)=C(N)N(N(C)C)C2=C1C(=O)CC(C)(C)C2 1010330 KQGJWBCOLPSOAU-GOSISDBHSA-N 366.465 2.908 50 40 FFGB Cc1ccc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)c(C)c1 408879199 BETBDVRVCJTERJ-UHFFFAOYSA-N 365.499 2.896 50 40 FFGB CNC(=O)/C(C#N)=C\c1cn(Cc2ccc(C(=O)OC)o2)c2ccccc12 409390551 FUDBXSSASIFWHK-LCYFTJDESA-N 363.373 2.722 50 40 FFGB Cc1nn(C)c(F)c1/C=N/NC(=O)COc1cc(Cl)ccc1Cl 252480041 BSPHCJJQTFBMLP-NGYBGAFCSA-N 359.188 2.704 50 40 FFGB CCc1c(C)sc(NC(=S)NNC(=O)c2ccco2)c1C(=O)OC 17075441 AVXSIQHGDQOUFS-UHFFFAOYSA-N 367.452 2.630 50 40 FFGB CC(C)=NNC(=O)CN(c1cccc(C)c1)S(=O)(=O)c1ccccc1 19948024 VKBNFBCEOAYBSM-UHFFFAOYSA-N 359.451 2.702 50 40 FFGB C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)/C(C#N)=C/c2ccc(N(C)C)cc2)C1 6534493 PLAIMSXANCZSMY-NLTVTKDGSA-N 369.465 2.707 50 40 FFGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 59503427 JFVKRVHIZZWKBW-YBFXNURJSA-N 354.366 2.807 50 40 FFGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1cccc([N+](=O)[O-])c1 110470028 AQXZNBCTUJTVER-SRZZPIQSSA-N 374.356 2.859 50 40 FFGB COc1cc(OC)c2cc(C(=O)N/N=C/c3ccc(OC)c(O)c3)[nH]c2c1 2328539 RNEHEOOVZWJCAH-KEBDBYFISA-N 369.377 2.663 50 40 FFGB NC(=O)c1ccc(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)nc1 63450909 ZOAXNFVTLZURLI-UHFFFAOYSA-N 359.600 2.898 50 40 FFGB O=C1OC(=O)[C@@H]2[C@H]1[C@H]1c3ccccc3C=CN1[C@@H]2C(=O)c1ccc(F)cc1 97940250 ZVZRUVBRIJRMSO-MLHJIOFPSA-N 363.344 2.734 50 40 FFGB O=C(Cc1ccc(F)cc1)N/N=C\c1cc(Br)ccc1O 83329333 HMGDHSJNHRKOFX-NVMNQCDNSA-N 351.175 2.987 50 40 FFGB Cn1cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc21 711764 DTCUHNHMKUQLRJ-VXLYETTFSA-N 352.350 2.616 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)CN2Cc3cc(C)c(C)cc3C2)c1 8336786 JLRXGNXYFAQPMT-LSHDLFTRSA-N 367.449 2.787 50 40 FFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccc(Br)s1 866588 JSYINMWGVJATLE-NSHDSACASA-N 355.213 2.765 50 40 FFGB CCOC(=O)c1c(NC(C)=O)sc2c1CC[C@@H](Br)C2=O 4696807 CDCGUOVAAKPRKR-MRVPVSSYSA-N 360.229 2.776 50 40 FFGB Cc1ccc(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)cc1 5477996 GIADFOWGSIJLCB-JAYDOHCTSA-N 350.212 2.505 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NCc2cccs2)c([N+](=O)[O-])cc1OC 4679941 UQFVBHZZMGAUNB-WUXMJOGZSA-N 373.390 2.897 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O)C(C)(C)C 408767507 LVCNLSLCYGGNHU-NBVRZTHBSA-N 353.488 2.608 50 40 FFGB Cc1cc(OCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)ccc1Cl 35655043 YTNLAXOZFJDVJV-QGMBQPNBSA-N 363.757 2.791 50 40 FFGB CCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NCC(F)(F)F)c1C 3367295 ULBTUWDIRQZFDF-VGOFMYFVSA-N 371.359 2.644 50 40 FFGB C[C@H](NC(=O)c1ccccc1)C(=O)NNc1c(F)c(F)c(F)c(F)c1F 28335365 MAKFBUSTWZXTPN-ZETCQYMHSA-N 373.281 2.644 50 40 FFGB Cc1nc2ccccn2c1C(=O)NNC(=S)Nc1ccc(Cl)cc1 8684675 SQFBOETWSLMDBM-UHFFFAOYSA-N 359.842 2.928 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1C 4695811 NCUUPQBMJKPSAY-VCHYOVAHSA-N 372.337 2.513 50 40 FFGB Cc1c(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)c2ccccc2n1C 409146778 UXSAPSFYHNYVLK-LSHDLFTRSA-N 364.405 2.778 50 40 FFGB COc1ccc(OCC(=O)N/N=C\c2ccc(Cl)c([N+](=O)[O-])c2)cc1 35282192 MGBITWSXSOBHFQ-NVMNQCDNSA-N 363.757 2.786 50 40 FFGB O=C(N[C@@]1(C(Cl)Cl)NC(c2ccccc2)=NC1=O)c1cccs1 1775975743 FLBQIEFSHINMMQ-OAHLLOKOSA-N 368.245 2.555 50 40 FFGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccccc1OC 15423061 DVNKTXFIJQXZSY-NSHDSACASA-N 357.248 2.704 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C(\C)CC(=O)NC2CCCCC2)c1 13573646 JQULFPWCPWTHLE-FYJGNVAPSA-N 361.442 2.649 50 40 FFGB CCCC1=C(C(=O)OCC)[C@@H](c2ccc3c(c2)OCO3)C(C#N)=C(N)O1 1227798 AUHHMDSUSFDJFN-INIZCTEOSA-N 356.378 2.840 50 40 FFGB C/C(CC(=O)Nc1cccc(Cl)c1)=N\NC(=O)c1ccc(O)cc1O 100090118 HOOBPDKNAWYXGL-KEBDBYFISA-N 361.785 2.886 50 40 FFGB Cc1cccc(OCC(=O)N/N=C/c2cc([N+](=O)[O-])cc(C)c2O)c1C 36247475 XQMMDFGCOCTKMW-DJKKODMXSA-N 357.366 2.755 50 40 FFGB CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccccc1O 408995142 JLEBKYHTLZEPBU-XDHOZWIPSA-N 356.382 2.911 50 40 FFGB C[C@H](/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCO2 17073436 FJKRWAWDLZOEDJ-NJDFMEINSA-N 355.350 2.918 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(N(C)C)cc2)c(OC)c1 408874723 FUDCCKKCCCOVPY-GZTJUZNOSA-N 365.433 2.993 50 40 FFGB O=C(NNC(=O)c1cccc(OCc2cscn2)c1)c1cccc(O)c1 9953580 HLVOPVHOFKCQNL-UHFFFAOYSA-N 369.402 2.503 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])cc1 59503545 UADPQMCXGYKKHJ-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB C/C(=N\NC(=O)c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 4729653 NNMGHFLWUUICQJ-YBFXNURJSA-N 351.318 2.855 50 40 FFGB Cc1ccc(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)cc1C 8474877 SSEYSTVHQULNHX-MTWVNVMRSA-N 364.239 2.813 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 8169067 YJUJLWFFXKYHKU-VPNURPJOSA-N 371.824 2.852 50 40 FFGB O=C(CCC(=O)N/N=C/[C@H]1C[C@@H]2CC[C@H]1C2)N/N=C/[C@H]1C[C@H]2CC[C@H]1C2 103623205 NXDNIKYHOJFYMV-SUNNERDNSA-N 358.486 2.843 50 40 FFGB C/C(CC(=O)N1CCCC1)=N\NC(=O)COc1ccc(Cl)cc1Cl 6997186 BZTRBRNRRNOFKL-YBFXNURJSA-N 372.252 2.877 50 40 FFGB Cc1sc2ncn(CC(=O)N/N=C/c3ccc(Cl)cc3)c(=O)c2c1C 7636364 XTLPZWLDDNQCLV-IFRROFPPSA-N 374.853 2.879 50 40 FFGB Cc1ccc(C)c(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)C)c2C)c1 408878237 YQLJALFEWYBEDN-SRZZPIQSSA-N 354.454 2.686 50 40 FFGB CCNC(=O)N1[C@@H](c2ccccc2)C(C#N)=C(O)N1c1nc(C)cc(C)n1 17074879 TTXDYGBVQGHYKG-INIZCTEOSA-N 364.409 2.894 50 40 FFGB CC(C)[C@H](C(=O)NNC(=O)C1CCCC1)n1cnc2cc(F)c(F)cc21 84409395 XQGBDLVIDSIEOB-MRXNPFEDSA-N 364.396 2.849 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)COc2ccc(OC)cc2)cc1OC 45331375 BRFDBXNBACCKBV-FYJGNVAPSA-N 370.405 2.798 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1cccc(OC)c1 4502864 CPASEJQBEWGUSA-HNNXBMFYSA-N 370.434 2.643 50 40 FFGB Cc1ccccc1NCC(=O)N/N=C1\C(=O)N(C(C)C)c2ccccc21 18148728 NIJUSGRKQBPGQH-NMWGTECJSA-N 350.422 2.682 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)COc1ccccc1Cc1ccccc1 104696958 SBQZRVXVGWXNIV-SDXDJHTJSA-N 364.401 2.525 50 40 FFGB Cn1cccc1/C=N/NC(=O)COc1ccc(Cl)cc1Br 2328368 GVRKUELBBKMRTB-CAOOACKPSA-N 370.634 2.970 50 40 FFGB O=C1O[C@@H]2[C@H](Br)[C@H]3C[C@@H]2[C@H]1[C@H]3C(=O)Nc1cccc(Cl)c1 8474797 IFAQTGVULZCIDC-JOGIVDDZSA-N 370.630 2.850 50 40 FFGB C/C(=N\NC(=O)CCC(=O)N/N=C(\C)c1ccc(C)o1)c1ccc(C)o1 4646835 IIBPNZJXNHJPIY-IWGRKNQJSA-N 358.398 2.650 50 40 FFGB COc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1 4742292 USOARPJXUZUQNF-INIZCTEOSA-N 358.353 2.836 50 40 FFGB O=C(NNS(=O)(=O)c1ccc(F)cc1)c1cc2c(s1)CCCCC2 7404808 VUPYSNPXUMTWIJ-UHFFFAOYSA-N 368.455 2.779 50 40 FFGB O=C(NNC(=O)c1cccnc1N1CCCCC1)c1ccc(Cl)cc1 40128389 PJVDIMXMZTYYNP-UHFFFAOYSA-N 358.829 2.800 50 40 FFGB C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](OC)[C@@H](OC(=O)C(C)C)[C@@H]12 585660629 SKCDPGIEMVQDCR-OWSLCNJRSA-N 362.422 2.532 50 40 FFGB biogenic,in-vitro CCOc1ccc(OC)cc1/C=N/NC(=O)COc1ccc(OC)cc1 3167332 STONFJXHTCBCAJ-UDWIEESQSA-N 358.394 2.632 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)c([N+](=O)[O-])cc1OC 5068984 YUKAVJQVRVJDST-OVCLIPMQSA-N 367.361 2.835 50 40 FFGB N#C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1O 33598303 ZBGBZOOTLSRHTP-XFFZJAGNSA-N 354.278 2.754 50 40 FFGB CCCCCCCC(=O)NNC(=O)c1c(O)n(CC)c2ccccc2c1=O 103722789 DUQWJMPZRQXMGX-UHFFFAOYSA-N 373.453 2.849 50 40 FFGB O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)C(=O)N1CCCCC1 59515491 XNLITUNAZBQZOV-PXLXIMEGSA-N 365.433 2.728 50 40 FFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@]21C(=O)Nc2cc(Cl)ccc21 4646501 DZQJECSUUILFIY-LJQANCHMSA-N 369.808 2.897 50 40 FFGB O=C(CNC1CCCCC1)N/N=C/c1ccc(O)c(Br)c1 409382106 KZGBSMZQBRSTMJ-GIJQJNRQSA-N 354.248 2.527 50 40 FFGB O=C(O)[C@@H]1C[C@H](Cl)[C@H](Sc2ccc([N+](=O)[O-])cc2)C[C@H]1C(=O)O 36550944 RMVAPMUOFNYPCC-WISYIIOYSA-N 359.787 2.858 50 40 FFGB COc1cc(/C=N/NC(=O)CNc2ccccc2C)cc(OC)c1OC 1187827 BEARYWKNMJXUGH-SRZZPIQSSA-N 357.410 2.583 50 40 FFGB CCN1C(=O)/C(=N\NC(=O)COc2ccc(Cl)cc2)c2ccccc21 102417015 MIZHWAWEUWIAGN-FXBPSFAMSA-N 357.797 2.606 50 40 FFGB COc1ccc(C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1 1097546 RRXIWXZCLHETNM-UHFFFAOYSA-N 356.422 2.833 50 40 FFGB CCc1ccc(OCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N(C)C)cc1 4180453 HMQXZFDPDHRYKG-UDWIEESQSA-N 370.409 2.752 50 40 FFGB O=C(NNC(=O)c1cncc(Br)c1)c1ccc(Cl)cc1 2629721 MVVBHUPVPBGHRU-UHFFFAOYSA-N 354.591 2.572 50 40 FFGB CCCOc1ccc(C(=O)NNC(=O)[C@H]2CC(C)=C(C)C[C@@H]2C(=O)O)cc1 2797213 NQQSZLWXQJHCBC-IRXDYDNUSA-N 374.437 2.684 50 40 FFGB Cc1ccc(OCC(=O)NNC(=O)COc2ccccc2Cl)cc1C 8183613 NOZUXFHHAFDWCW-UHFFFAOYSA-N 362.813 2.562 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(C)cc2)c1C 58884292 KWKHDNUUPRCVFF-FYJGNVAPSA-N 354.454 2.721 50 40 FFGB COc1cc(Br)c(/C=C(\C#N)C(=O)NC2CC2)cc1OC 7063243 OISPZYMFRIMWIW-BJMVGYQFSA-N 351.200 2.652 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(OC)cc1C 408606116 OEQLCSQSVZGRMH-HNNXBMFYSA-N 370.434 2.562 50 40 FFGB CCOc1cccc(/C=N\NC(=O)COc2cccc3cccnc23)c1O 409022103 JKGUTKJPDRAEID-UUYOSTAYSA-N 365.389 2.868 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1ccc(-c2ccccc2C(=O)O)o1 408812391 LUFZTXGMBLINFP-ACCUITESSA-N 354.362 2.704 50 40 FFGB COc1ccc(OC)c(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)c1 408887518 RHQJCYOSOAGWGW-NTEUORMPSA-N 352.346 2.948 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@H]2CC=C[C@H]12)N/N=C1\C[C@H]2CC=C[C@@H]12 5725505 KVMHVJCPUHROLG-KRXGKYMLSA-N 354.454 2.683 50 40 FFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(N3CCCCC3)o2)cc1 6186243 MTWHVEQUHCDQNN-DEDYPNTBSA-N 354.410 2.992 50 40 FFGB CCOc1cccc(OCC)c1[C@H]1C(C#N)=C(N)Oc2oc(C)cc(=O)c21 1073920 OMGUTEVRYURYBF-INIZCTEOSA-N 368.389 2.964 50 40 FFGB Cc1ccccc1NC(=O)/C(C#N)=C\c1cn(CC(N)=O)c2ccccc12 107594620 ARYLZJJYGOTQEN-GDNBJRDFSA-N 358.401 2.981 50 40 FFGB CC1(C)[C@]2(C)CC[C@]1(C(=O)O)C(=O)/C2=N\NC(=O)c1ccc(Cl)cc1 100868677 PBDYJAHQGQMCFY-LNSJNNGNSA-N 362.813 2.906 50 40 FFGB Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)c1cccs1 2132120 FWUCXBCAKTUJIU-UHFFFAOYSA-N 365.842 2.890 50 40 FFGB Cc1nccc(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n1 58423452 ZTINDLHXDOPULM-UHFFFAOYSA-N 356.382 2.727 50 40 FFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@]21C(=O)Nc2ccc(Cl)cc21 4142269 XWAVXXGMXXFKDC-IBGZPJMESA-N 369.808 2.897 50 40 FFGB O=C(Oc1ccc(/C=N/NC(=O)c2ccccc2O)cc1)c1ccco1 4505847 OLZRFZKRQFCXQU-UDWIEESQSA-N 350.330 2.968 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@@H]2C[C@@H]2c2ccccc2F)c2ccccc21 70019296 JKDYOPWTHRBKTK-HUUCEWRRSA-N 351.381 2.882 50 40 FFGB C[C@H](SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1)C(=O)Nc1ccccc1F 9683003 ICPACHAKFFHWHW-QWRGUYRKSA-N 372.425 2.917 50 40 FFGB CCc1ccc(N(CC(=O)NN=C(C)C)S(=O)(=O)c2ccccc2)cc1 409027005 OYZJYHFQMGFSAD-UHFFFAOYSA-N 373.478 2.956 50 40 FFGB CCN(NC(=O)C[C@@H](NC(N)=O)c1ccccc1C)c1ccc(C)cc1 32423649 GRAYGZXVLWWZPZ-GOSISDBHSA-N 354.454 2.961 50 40 FFGB CCOC(=O)C1=C(CBr)NC(=O)N[C@@H]1c1ccccc1Cl 33374241 JNUSJEKFDIAYTJ-GFCCVEGCSA-N 373.634 2.906 50 40 FFGB O=C1O[C@H]2[C@@H]3C[C@H]([C@@H](C(=O)Nc4ccccc4Cl)[C@@H]13)[C@H]2Br 100198294 IHRKASQQGMYREB-ZNOWBECESA-N 370.630 2.850 50 40 FFGB O=C(NNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)c1ccc(Cl)cc1 2632030 WVKYRHFILYFQKX-QGZVFWFLSA-N 374.824 2.973 50 40 FFGB O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)C(=O)NC1CCCC1 59515583 MULRJMQHGUMSIL-HYARGMPZSA-N 365.433 2.775 50 40 FFGB CCC1=NN(C(=O)c2ccccc2)[C@](C)(NNC(=O)c2ccccc2)C1 4018175 PXJFKGXQQOFJSH-FQEVSTJZSA-N 350.422 2.949 50 40 FFGB CCSC1=C(C#N)[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)OC)C(=O)N1 9332877 WKEUIGQOEPOIBX-QWHCGFSZSA-N 350.827 2.831 50 40 FFGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1cccc([N+](=O)[O-])c1 5569059 LFWVLJYRPZWJTQ-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB Cc1cc(C)cc(N2C(=O)C[C@H](NNC(=O)c3cccc(Cl)c3)C2=O)c1 100129871 PFRRTGMAFGDKAG-INIZCTEOSA-N 371.824 2.523 50 40 FFGB O=C(COc1ccc(/C=N\NC(=O)c2ccco2)cc1)NC1CCCCC1 58883145 NJZTXQWWPLWLMA-BKUYFWCQSA-N 369.421 2.871 50 40 FFGB COc1ccc(/C=N/NC(=O)/C=C2\Nc3cc(C)c(C)cc3NC2=O)cc1 408720749 YGEHQOHXTWCTJE-DABDJHBXSA-N 364.405 2.710 50 40 FFGB Cc1c(C(=O)NNS(=O)(=O)c2cc(F)cc(F)c2)oc2ccccc12 12973735 RKZROHFRVMBQGN-UHFFFAOYSA-N 366.345 2.643 50 40 FFGB O=C(NNC(=O)c1ccco1)c1ccc(NC(=O)c2cccs2)cc1 13021826 DYQGLSNIBPQBLS-UHFFFAOYSA-N 355.375 2.668 50 40 FFGB CC(C)(C)[Si](C)(C)Oc1cccc2c1CN([C@@H]1CCC(=O)NC1=O)C2=O 2362803198 MNBBVQMRQVKNLZ-CQSZACIVSA-N 374.513 2.832 50 40 FFGB N#C/C(=C\c1cn(CC(N)=O)c2ccccc12)C(=O)NC1CCCCCC1 876879 VUGZGCBONQLKOB-RVDMUPIBSA-N 364.449 2.873 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2ccc(F)cc2)cc1 100522576 LSCYNJCRKLFQPS-LPYMAVHISA-N 357.385 2.647 50 40 FFGB COc1ccc2nc(N[C@]3(C(F)(F)F)C(=O)NC(C)=C3C#N)sc2c1 12402642 AGXWVMHNTCWIPQ-AWEZNQCLSA-N 368.340 2.945 50 40 FFGB CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)NNC(=O)c1cccs1 103916740 QZKMBZDVKNQOSY-GDNBJRDFSA-N 358.398 2.818 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2ccc3c(O)[nH]c(=S)nc3c2)c(C)c1 47932337 LDHCRDHNEARGHJ-UHFFFAOYSA-N 368.418 2.690 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3cccc(Cl)c3)CC2=O)cc1 409273273 WTDYIKOZUVKSKM-WHJAWBAWSA-N 371.824 2.852 50 40 FFGB CCN(CC)N(C(C)=O)[C@H]1C[C@@H](c2ccccc2)C(C#N)(C#N)C1(C#N)C#N 2273535 APBGEMOUPARITI-OALUTQOASA-N 374.448 2.715 50 40 FFGB C/C(=N/NC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccco1 20081920 RTICZTFVGGCJDT-QNGOZBTKSA-N 374.872 2.591 50 40 FFGB CCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(CCC)c1=O 100534770 HDZVQOMBOSVYMS-UHFFFAOYSA-N 373.453 2.849 50 40 FFGB COc1cccc(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)c1 8733192 ZHSWCFXLSOPZBD-CQSZACIVSA-N 371.275 2.950 50 40 FFGB CCO[C@@]1(c2ccccc2)C[C@H]1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 4935955 SDYRFMRPNJOSNS-WMXHQWKFSA-N 353.378 2.997 50 40 FFGB CC(=O)Nc1ccc(/C(C)=N\NC(=O)CO/N=C/c2ccccc2)cc1 34839669 CYVUCFLVCUPENU-DDLXULCYSA-N 352.394 2.536 50 40 FFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@H](C)CC)cc1OCC 408801070 SLDNCTPOQMCVQL-DWKHYPNZSA-N 374.437 2.849 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc(OC)cc2)cc1 3398129 OVLNHWWHMUPZHG-RVDMUPIBSA-N 366.373 2.793 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)NCc2ccc3c(c2)OCO3)ccc1O 5872181 QKBOCBCLOIRIMS-VIZOYTHASA-N 366.373 2.743 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccccn3)c2[C@@H]1c1ccc([N+](=O)[O-])s1 4171077 GPPYLWPMYGXZCE-LBPRGKRZSA-N 366.362 2.660 50 40 FFGB CN(C)c1ccc(/C=C(\C#N)c2n[nH]c(N)c2C#N)cc1Br 3902888 NZQXJQZZGBYJQE-BJMVGYQFSA-N 357.215 2.756 50 40 FFGB Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1/C=C(\C#N)c1ccccn1 6339587 KYJATHJTLCWBSR-YQCJOKCJSA-N 362.842 2.664 50 40 FFGB CC(C)=NNC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1 409137036 URPRISWATQIDTQ-UHFFFAOYSA-N 359.451 2.946 50 40 FFGB O=C(O)c1cccc(-c2ccc(/C=N/NC(=O)[C@H](O)c3ccccc3)o2)c1 5647757 GDIJOLLUZZBBLB-AGKWGAAGSA-N 364.357 2.829 50 40 FFGB CN(C)c1ccc(/C=N/NC(=O)c2ccccc2NC(=O)C2CC2)cc1 1739590 ABTGZYJSUVSTMB-FYJGNVAPSA-N 350.422 2.865 50 40 FFGB CCCN(CCC)c1ccc(/C=N/NC(=O)CNC(=O)c2ccco2)cc1 3113478 GCCMSSYDLUMERN-HYARGMPZSA-N 370.453 2.786 50 40 FFGB O=C(N/N=C/c1ccc(Br)cc1)C(=O)Nc1ccccc1F 3008842 LGGDXJIRSRINPA-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C2\C(=O)N(C(C)C)c3ccccc32)cn1 61719366 YIYDJRZRVXQNAR-SDXDJHTJSA-N 362.389 2.761 50 40 FFGB O=C(NNC(=O)c1cc(Cl)sc1Cl)c1ccc2c(c1)OCO2 26964708 LOGJUGKZEVRUTO-UHFFFAOYSA-N 359.190 2.858 50 40 FFGB C/C(=N\NC(=O)c1ccc(O)cc1)c1ccc(N2CCOCC2)c(F)c1 7945322 TTXJJRLWWMOPOK-FYJGNVAPSA-N 357.385 2.522 50 40 FFGB OB(O)c1ccccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1 2362804720 JBIZULNJEBTYOY-UHFFFAOYSA-N 353.190 2.552 50 40 FFGB O=C(N/N=C/c1cc(Br)cs1)[C@H]1COc2ccccc2O1 2284199 LWWPCMSMTFJTED-JWYAVWBNSA-N 367.224 2.801 50 40 FFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1ccc(Br)c(C)c1 16282160 FJPNMLSREWOVOB-JYRVWZFOSA-N 360.211 2.892 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(OC)c2)cc1 7869232 JHZGFZPCVVMBBF-DEDYPNTBSA-N 355.394 2.573 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)c(OC)c1 2774264 LOMPNFQSWBFQQN-UKTHLTGXSA-N 352.346 2.948 50 40 FFGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 59516190 QRZMTAPPQSVGLF-QGMBQPNBSA-N 357.757 2.968 50 40 FFGB COc1ccc(NCC(=O)NNC(=O)C2(c3ccc(Cl)cc3)CC2)cc1 12534341 LMRMEYCJZSCFJD-UHFFFAOYSA-N 373.840 2.640 50 40 FFGB CCOc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCCCl)cc1OC 4380872 BACKOFJENFODPY-OAHLLOKOSA-N 368.817 2.504 50 40 FFGB COc1ccccc1C(=O)N/N=C1\C(=O)Nc2c(Br)cccc21 5559114 UIUBMVBLMDKGBB-UHFFFAOYSA-N 374.194 2.544 50 40 FFGB Cc1ccc(CN2CCN(CC(=O)N/N=C/c3ccccc3C)CC2)cc1 19367336 XUJHCJHXTOBVAM-HZHRSRAPSA-N 364.493 2.571 50 40 FFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)C)c32)c(OC)c1OC 5052106 CMNSVWCCTHXWMS-CYBMUJFWSA-N 370.409 2.777 50 40 FFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(C(=O)O)cc1 6472318 ZGRYTFNGVXFRPR-GIJQJNRQSA-N 373.390 2.677 50 40 FFGB CN(CC(=O)NNC(=O)c1ccccc1C(F)(F)F)c1ccccc1 32937813 OGKVDVZETFHMKS-UHFFFAOYSA-N 351.328 2.603 50 40 FFGB CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)c3cccc[n+]3[O-])cc2C1 44980326 PFIUUBDKIYEUNZ-ZDUSSCGKSA-N 373.478 2.607 50 40 FFGB NC(=O)CCn1cc(/C=N/NC(=O)c2ccc(Cl)cc2)c2ccccc21 409373825 VDICQFBAEIKKLO-SSDVNMTOSA-N 368.824 2.934 50 40 FFGB COc1cc(/C=N/NC(=O)c2cc(C(C)(C)C)n[nH]2)cc(Cl)c1O 12341860 FBBCKKFSNMQKSK-QGMBQPNBSA-N 350.806 2.839 50 40 FFGB COCC1=C(C(=O)OC)[C@@H](c2ccccc2C(F)(F)F)C(C#N)=C(N)O1 4189178 HNZXSPXHHMADRV-ZDUSSCGKSA-N 368.311 2.587 50 40 FFGB CCc1ccccc1N(CC(=O)NN=C(C)C)S(=O)(=O)c1ccccc1 408783232 MRHHWYAVVNELTI-UHFFFAOYSA-N 373.478 2.956 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=C(/C#N)C(=O)Nn1c(C)ccc1C 409377915 KNAMZEHCNNLSHJ-YBEGLDIGSA-N 364.361 2.702 50 40 FFGB N#C/C(C(N)=O)=C1\Oc2c(cc(O)cc2-c2ccc([N+](=O)[O-])cc2)S1 13596701 BZVHWPKATSXWLL-VBKFSLOCSA-N 355.331 2.672 50 40 FFGB COc1c(Cl)cc(Cl)cc1/C=C/C(=O)NNC(=O)c1ccncc1 1268663 VEPVXMWIQBMTOB-NSCUHMNNSA-N 366.204 2.871 50 40 FFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)c1OC 59506612 MCYIYNIITSWQPD-CIAFOILYSA-N 369.421 2.916 50 40 FFGB CCOc1ccc(OCCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 12904621 ZOSDQKCHLNOAEH-UHFFFAOYSA-N 362.813 2.969 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1ccc(C)cc1 4691379 RHNZUEINYDAOLP-HYARGMPZSA-N 367.405 2.901 50 40 FFGB Cc1ccc(C(=O)N/N=C2/C(=O)Nc3ccc([N+](=O)[O-])cc32)c(Cl)c1 4844487 CMEZWQIMBIPALA-UHFFFAOYSA-N 358.741 2.643 50 40 FFGB CNC(=O)/C(C#N)=C\c1cccc(OC)c1OCc1ccc(C(=O)O)cc1 409186366 BADQGXSGMLGACT-YBEGLDIGSA-N 366.373 2.625 50 40 FFGB COc1ccc(/C=C/C(=O)N/N=C/c2cc(OC)c(OC)c(OC)c2)cc1 409057277 KCKWKCGZHKDOCO-FPQBULDBSA-N 370.405 2.885 50 40 FFGB C[C@H](C(=O)N/N=C\c1c[nH]c2ccccc12)n1cnc2ccccc2c1=O 31857552 IMVYDLSZFTZSSH-ICXMQADFSA-N 359.389 2.589 50 40 FFGB O=C(NCCCN1CCOCC1)[C@@H]1Cc2ccccc2[C@H]1C(Cl)Cl 95677007 HCDPYHLDBBGAFP-HZPDHXFCSA-N 371.308 2.585 50 40 FFGB Cc1ccccc1C(=O)N/N=C1/C(=O)N(CN2CCCC2)c2ccccc21 102932747 AUSZRBYPDKUQIH-ZBJSNUHESA-N 362.433 2.529 50 40 FFGB COC(=O)[C@@]12CC[C@](CBr)(C(=O)[C@@H]1Br)C2(C)C 109275156 PVYFESIMHVMBHV-CQFDHEJISA-N 368.065 2.693 50 40 FFGB CCCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2ccccc2)c2ccccc21 5267629 DBAOXZMLVKXCID-ZCXUNETKSA-N 358.401 2.638 50 40 FFGB CC(=O)Nc1ccc(N/C=C2\C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)cc1 9419552 SPKOQPCBKVKKCK-ZDLGFXPLSA-N 366.421 2.806 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccccc1O 409069177 LRUDPVVPFZQOJI-UNOMPAQXSA-N 354.366 2.665 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 408963991 KQEZZWALWHHZGQ-PCXKXAPESA-N 353.422 2.630 50 40 FFGB O=C(CC(=O)NC1CCCCC1)N/N=C/c1ccc(Br)cc1 5569265 KXUKYESZZZTBNG-WOJGMQOQSA-N 366.259 2.738 50 40 FFGB COc1cc(C(=O)N/N=C/c2ccc(C(=O)O)cc2)ccc1OC(C)C 6687229 BDTHPEULXJXMQT-RGVLZGJSSA-N 356.378 2.945 50 40 FFGB O=C(N/N=C/c1c(F)cccc1Cl)[C@@H]1CC(=O)N(c2ccccc2)C1 656802 GPONVGJEPJYEDD-FZTAQKCPSA-N 359.788 2.982 50 40 FFGB Cc1nn(Cc2ccc(Cl)cc2)c2nc(C3CC3)cc(C(=O)NN)c12 12394530 NOUMMINTEFIHRU-UHFFFAOYSA-N 355.829 2.922 50 40 FFGB COc1cccc(OC)c1C(=O)NN(C)c1cc(C)c(C#N)c(Cl)n1 12446167 MPURIYWEUOSKMZ-UHFFFAOYSA-N 360.801 2.714 50 40 FFGB O=C(N/N=C/c1ccccn1)C(=O)Nc1ccc(Oc2ccccc2)cc1 58884744 JLIVSXVXKPTKIV-HYARGMPZSA-N 360.373 2.963 50 40 FFGB COc1ccc([C@@H]2[C@H]3C[C@H]4[C@H](OC(=O)[C@H]24)[C@@H]3I)cc1 104120274 KJZGQLKFWYXPAD-HUXGKSLCSA-N 370.186 2.774 50 40 FFGB Cc1ccc(CC(=O)N/N=C/c2ccc(I)o2)cc1 409363654 VFVCSJMBKVVWHT-CXUHLZMHSA-N 368.174 2.885 50 40 FFGB C[C@@H](C(=O)N/N=C\c1c[nH]c2ccccc12)n1cnc2ccccc2c1=O 31857549 IMVYDLSZFTZSSH-DOQYOOLYSA-N 359.389 2.589 50 40 FFGB CCOc1cc(/C=N\NC(N)=O)ccc1OCCOc1ccccc1C 30734531 RAPNHDUZGYUNNN-BKUYFWCQSA-N 357.410 2.854 50 40 FFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)cc1 58883433 VPTRJPLTZQSRCS-OEAKJJBVSA-N 367.449 2.759 50 40 FFGB O=C(Cc1csc(N2CCCC2=O)n1)NNc1cccc(Cl)c1 61196077 XBMLYRCLBZTOJJ-UHFFFAOYSA-N 350.831 2.609 50 40 FFGB COc1ccc([C@H]2[C@@H]3C(=C[C@@H]4CC[C@H]3N4C)C(C#N)=C(N)C2(C#N)C#N)cc1 34704175 QAWCSHGMVQKVTE-PSAKCFHXSA-N 371.444 2.581 50 40 FFGB CC(C)(C)OC(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 2294123 ONEQDPHJUZTTDG-MKMNVTDBSA-N 360.164 2.922 50 40 FFGB N#C/C(=C/c1ccc(OCC(=O)O)cc1)C(=O)NCCCc1ccccc1 409253660 UZKNAIKXJMGALE-AQTBWJFISA-N 364.401 2.806 50 40 FFGB CC(C)Oc1ccc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)c(O)c1 408589779 MVBJGXNSHZEQPK-KEBDBYFISA-N 356.378 2.601 50 40 FFGB Cc1cccc(C(=O)N/N=C\c2ccc(SCCO)c([N+](=O)[O-])c2)c1 32124881 RRGLWHLQINVDMZ-WQRHYEAKSA-N 359.407 2.752 50 40 FFGB Cc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1Cl 32118967 ZANXUAQHVQGARH-UHFFFAOYSA-N 353.856 2.659 50 40 FFGB COc1cc(/C=N/NC(=O)[C@H]2[C@H]3CCCC[C@]23C)c([N+](=O)[O-])cc1OC 100182281 KNHUWRAENMYBRW-WHXHWSIZSA-N 361.398 2.888 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc(OC)c1O 3253580 LHXCTTHZCOUQJQ-MHWRWJLKSA-N 352.390 2.675 50 40 FFGB N#CC1=C(SCC(N)=O)NC(=O)C[C@H]1c1cccc(Cl)c1Cl 2312044 QYMBSYGVNBUBLZ-QMMMGPOBSA-N 356.234 2.551 50 40 FFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)COc1ccccc1C 4416370 SXDVNZNFVDVLND-PXLXIMEGSA-N 369.421 2.903 50 40 FFGB COc1cc(/C=C(/C#N)C(N)=S)ccc1Oc1ncccc1[N+](=O)[O-] 33736256 UVEVQRMPOWLADT-XFFZJAGNSA-N 356.363 2.984 50 40 FFGB O=C(O)c1ccc(P(=O)(c2ccccc2)c2ccc(C(=O)O)cc2)cc1 45331663 UVTXHAOLTBFLDL-UHFFFAOYSA-N 366.309 2.722 50 40 FFGB CC1(C)CC(=O)C(=CNNC(=O)c2ccccc2Br)C(=O)C1 5614191 XYBZBKSAXJUWCE-UHFFFAOYSA-N 365.227 2.526 50 40 FFGB COc1cc(/C(C)=N/NC(=O)CNc2ccccc2)cc(OC)c1OC 20931020 ULRNTMOZLYCUPN-FYJGNVAPSA-N 357.410 2.665 50 40 FFGB CC1(C)[C@H](C(=O)NNC(=O)c2ccccc2Cl)CC[C@]1(C)C(=O)O 3140915 YEASDIDAPOSPIL-APPDUMDISA-N 352.818 2.628 50 40 FFGB CC1=C(C(=O)N2CCOCC2)CC/C(=N/NC(=O)Nc2ccccc2)C1 5305424 VNGCXCKUUDZILA-PGMHBOJBSA-N 356.426 2.523 50 40 FFGB C/C(=N/NC(=O)CCC(=O)NCc1ccccc1)c1ccc([N+](=O)[O-])cc1 4523923 PMKRWOYVEVMTDE-STZFKDTASA-N 368.393 2.532 50 40 FFGB N#CC1=C(S)N(c2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)NC1=O 9089674 JRAHJOUJFQVGQC-OAHLLOKOSA-N 352.375 2.895 50 40 FFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1N 409042505 XXHUCHLRXNBYRW-RGVLZGJSSA-N 372.222 2.807 50 40 FFGB C[C@@H]1CCc2sc(C(=O)NNC(=O)c3n[nH]c4ccccc34)cc2C1 8294854 MELOFINAUSRYKE-SNVBAGLBSA-N 354.435 2.824 50 40 FFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1cccc(Cl)c1 409221470 QTODDDUPLLCONL-FYJGNVAPSA-N 373.840 2.949 50 40 FFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1cc2cc([N+](=O)[O-])ccc2o1 408966616 PNWUCQCQESKTMB-QGMBQPNBSA-N 353.290 2.834 50 40 FFGB COc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)c([N+](=O)[O-])cc1OC 15222297 KNHUWRAENMYBRW-FZXIHYQPSA-N 361.398 2.888 50 40 FFGB C[C@@H](Nc1ccc(Br)cc1)C(=O)N/N=C1/CCCCCN1 3186176 IKAVRZGACDEXAW-LLVKDONJSA-N 353.264 2.843 50 40 FFGB O=C(N/N=C/c1cc(Br)cs1)[C@@H]1COc2ccccc2O1 2284197 LWWPCMSMTFJTED-UDRREKMYSA-N 367.224 2.801 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@@H]1c1cccc([N+](=O)[O-])c1 100201189 SQYIEWGQPYEFJA-OAHLLOKOSA-N 373.324 2.736 50 40 FFGB CCOC(=O)c1c(NC(C)=O)sc2c1C(=O)[C@@H](Br)CC2 704891 JYOZIRSGNYACQD-ZETCQYMHSA-N 360.229 2.776 50 40 FFGB Cc1nc2ccc(Br)cn2c1C(=O)N/N=C/c1cccc(O)c1 59435411 REHLJRVEANIMCA-QGMBQPNBSA-N 373.210 2.875 50 40 FFGB N#Cc1ccc(OCC(=O)N/N=C/c2c(F)c(F)c(F)c(F)c2F)cc1 6566090 HGQIQBXYINMJOU-TXNBCWFRSA-N 369.249 2.783 50 40 FFGB COc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)cc2c1OCCO2 7159104 PQTSLCRXGFFQFW-NTEUORMPSA-N 352.394 2.848 50 40 FFGB O=C(CN1Cc2ccccc2C1)N/N=C/c1ccc(Br)cc1 409196833 RKEYFAZJDOAVKM-DJKKODMXSA-N 358.239 2.915 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1ccc(N2CCCC2)cc1 408677970 WNUUISKDZCQSEQ-XDHOZWIPSA-N 354.366 2.665 50 40 FFGB COc1cc(C#N)ccc1OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C 12636198 LNGLATKGAIGDAD-UHFFFAOYSA-N 374.400 2.836 50 40 FFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCSc1ccccc1 6405134 HTDPRQFOHHYWAO-ZDUSSCGKSA-N 362.426 2.923 50 40 FFGB O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C1CCCC1 7166926 YETKSMCCBYZXRM-UHFFFAOYSA-N 368.433 2.982 50 40 FFGB O=C(NC[C@H]1CCCO1)NNC(=O)c1c[nH]cc1-c1ccc(Cl)s1 84445349 HPNXGZHPZJREIM-SECBINFHSA-N 368.846 2.520 50 40 FFGB O=C(NNS(=O)(=O)c1cccc(Cl)c1)C12CC3CC(CC(C3)C1)C2 16154312 RYOSUMJRJWQCQD-UHFFFAOYSA-N 368.886 2.866 50 40 FFGB CC1=C(C(=O)OCCCl)[C@H](c2ccccc2OC(C)C)NC(=O)N1 4492351 FIRXBXPGVJVJEE-HNNXBMFYSA-N 352.818 2.884 50 40 FFGB O=C(NNC(=O)c1ccccc1OC[C@@H]1CCCO1)c1cccc(Cl)c1 32491509 KOGCXANGIMENQF-HNNXBMFYSA-N 374.824 2.973 50 40 FFGB COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1 660031 NQHXAMLSFWABPY-INIZCTEOSA-N 373.368 2.533 50 40 FFGB O=C(CCc1ccccc1)N/N=C/c1cc(Br)c(O)cc1O 59425723 FKGNNNSOPIGPGI-VCHYOVAHSA-N 363.211 2.943 50 40 FFGB COC(=O)[C@@]12CC[C@](CBr)(C(=O)[C@H]1Br)C2(C)C 100931622 PVYFESIMHVMBHV-VSYUYLJXSA-N 368.065 2.693 50 40 FFGB CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)c3cnsn3)cc2C1 58423826 YOVCEMBDFQJZCM-JTQLQIEISA-N 364.496 2.825 50 40 FFGB COc1ccc(C(=O)N/N=C(\CCC(=O)O)c2ccccc2)cc1OC 6247034 CIYMGEDWCOFNRV-HMMYKYKNSA-N 356.378 2.703 50 40 FFGB O=C(NNS(=O)(=O)c1ccccc1F)c1cc(Cl)ccc1Cl 7382972 JYHGEDZCRQNNSS-UHFFFAOYSA-N 363.197 2.756 50 40 FFGB CC1(C)C(C#N)=C(SCC(=O)N2CCCCCCC2)NC(=O)[C@H]1C#N 7693097 PFCFPTARAVJMTE-CYBMUJFWSA-N 360.483 2.543 50 40 FFGB CC(C)c1ccc2c(c1)/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N2 7893612 JTYQHSXXXHSBCO-UHFFFAOYSA-N 352.350 2.804 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 408963988 KQEZZWALWHHZGQ-NWGMWSOJSA-N 353.422 2.630 50 40 FFGB CCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc(Cl)cc3)ccc21 40142782 ZSOWZIQLPRPKML-UHFFFAOYSA-N 371.824 2.714 50 40 FFGB CCOC(=O)/C(C#N)=C/Nc1ccc2nc(N3CCOCC3)sc2c1 101018643 SHNOOYHYSFVHAE-VAWYXSNFSA-N 358.423 2.515 50 40 FFGB C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NN=C1CCCCCC1 6175231 PTPUWXCXEVZVHR-LBPRGKRZSA-N 371.890 2.833 50 40 FFGB Cc1cccc(N(CC(=O)NN=C2CCCCCCC2)S(C)(=O)=O)c1 20207722 VCIQPDSOUMZVKJ-UHFFFAOYSA-N 365.499 2.978 50 40 FFGB NC(=O)CCn1cc(/C=N/NC(=O)c2ccccc2Cl)c2ccccc21 408589197 KYZMCRCJVFXYDL-SSDVNMTOSA-N 368.824 2.934 50 40 FFGB C#CCn1cc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)c2ccccc21 409256436 LEMKNMGQJDHVBD-WSDLNYQXSA-N 359.385 2.696 50 40 FFGB N#C/C(=C/c1ccc(C(=O)O)cc1)C(=O)N1CCN(c2ccccc2)CC1 96997090 CNRXMFQYXBZJNX-JXAWBTAJSA-N 361.401 2.641 50 40 FFGB COc1ccc([C@@H]2Nc3ncnn3C(N)=C2C#N)cc1OCc1ccccc1 18199285 KDHXGDFRWIXHLG-SFHVURJKSA-N 374.404 2.683 50 40 FFGB CCOc1cccc(/C=N/NC(=O)c2cncc(Br)c2)c1O 3151341 SFBSFQJVSISSOX-QGMBQPNBSA-N 364.199 2.712 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC#N)cc2)cc1 408796027 OBCICZAUSKOZPG-FOWTUZBSSA-N 361.357 2.921 50 40 FFGB O=C(N/N=C/c1cc2c3c(c1O)CCCN3CCC2)c1ccccc1O 2408678 XRPDZGHUTLBFJI-CIAFOILYSA-N 351.406 2.561 50 40 FFGB O=C(NNS(=O)(=O)c1cccc(Cl)c1Cl)c1ccccc1F 8762876 AHUNROKOTIUHGD-UHFFFAOYSA-N 363.197 2.756 50 40 FFGB C=CCc1cc(/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1O 409199887 FKGKGHCBHNMGID-ODLFYWEKSA-N 355.350 2.801 50 40 FFGB Cc1cc(C)n(CC(=O)NNC(=O)[C@@H](SCc2ccccc2)C(C)C)n1 65563042 YEBCWBQGINSAPJ-SFHVURJKSA-N 374.510 2.605 50 40 FFGB CCSC1=C(C#N)[C@@H](c2ccccc2Cl)[C@@H](C(=O)OC)C(=O)N1 9317110 YOYYWBVGEURTTI-CHWSQXEVSA-N 350.827 2.831 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)CNc2ccc3c(c2)OCO3)cc1 409171885 CLHPTJSPOUNDRO-FYJGNVAPSA-N 355.394 2.766 50 40 FFGB COc1cccc(/C=N/NC(=O)C(C)(C)O)c1OCc1ccc(F)cc1 32578443 AFZACSZNWDCRMI-SRZZPIQSSA-N 360.385 2.634 50 40 FFGB O=C(O)COc1ccc(/C=N/NC(=O)c2cccc(F)c2)cc1Cl 408854517 HFRBNOONISURFI-UFWORHAWSA-N 350.733 2.706 50 40 FFGB C[C@H](Br)C(=O)NC[C@@H](O[C@@H]1CCOC1)c1cccc(F)c1 95097932 VHPHYPYBRHIIEX-ZLKJLUDKSA-N 360.223 2.572 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1COc2ccccc2O1 8106869 CUTCYPNACIOEJG-AOVQIXHVSA-N 361.741 2.538 50 40 FFGB CCC1(c2ccccc2)C(=O)N(CCCl)C(=O)N(CCCl)C1=O 1563129 FLCONVLXKMBYMS-UHFFFAOYSA-N 357.237 2.603 50 40 FFGB CN(NC(=O)CCc1nc(=O)c2c3c(sc2[nH]1)CCC3)c1ccccc1 32863726 XGSMBEQEEDFFLX-UHFFFAOYSA-N 368.462 2.574 50 40 FFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2cccc3ccccc23)cc1 7783523 URURNRDEEGQEJR-OEAKJJBVSA-N 361.401 2.615 50 40 FFGB CC/C(NNC(=O)c1ccccc1O)=C1/C(=O)N(c2ccccc2)N=C1C 677141 XHDHOOQHJVLTPT-VLGSPTGOSA-N 364.405 2.713 50 40 FFGB Cc1ccc(C)c(OCC(=O)N/N=C/c2ccc(O)c([N+](=O)[O-])c2)c1C 18209517 XOFPWDXRBFMWFM-DJKKODMXSA-N 357.366 2.755 50 40 FFGB Cc1cc(C(=O)NN[C@@H](C(=O)NC2CC2)c2ccccc2)c2ccccc2n1 15510609 WPKKNHBFMFZCNZ-HXUWFJFHSA-N 374.444 2.798 50 40 FFGB CCOc1cc(/C=N\NC(=O)Cc2ccc(C)cc2)cc([N+](=O)[O-])c1O 409360843 NQBHUBZSGIRJPQ-ODLFYWEKSA-N 357.366 2.700 50 40 FFGB Cc1nc(CC(=O)NNC(=O)/C=C/c2cccc(C(F)(F)F)c2)cs1 33029069 USCBXDAPTCKDSD-AATRIKPKSA-N 369.368 2.874 50 40 FFGB COC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 15357238 KIGIERXBTLCGIH-ZROIWOOFSA-N 351.318 2.927 50 40 FFGB O=C(CC(=O)N/N=C\c1c(O)ccc2ccccc12)NCc1ccccc1 59444834 MUYIXNHYKDCZIJ-UCQKPKSFSA-N 361.401 2.702 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 1189781 ISKPTXHKIOZOLH-WUXMJOGZSA-N 367.317 2.878 50 40 FFGB COc1ccccc1NC(=O)COc1ccc(/C=N\NC(=O)C(C)C)cc1 58883351 ZSXVRDJQMQEIFT-MTJSOVHGSA-N 369.421 2.819 50 40 FFGB CCCOc1ccc(C(=O)CCC(=O)NNC(=O)Cc2ccccc2)cc1 12893411 IVVWRKLRZAUKTG-UHFFFAOYSA-N 368.433 2.828 50 40 FFGB O=C(Cc1cccc2ccccc12)NNS(=O)(=O)c1ccccc1F 12919908 BMNDNCXGYMWFLG-UHFFFAOYSA-N 358.394 2.531 50 40 FFGB C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)c1ccccc1F 9856626 AVBGCCFGSGFVSX-SNVBAGLBSA-N 358.398 2.697 50 40 FFGB Cc1ccc(OCC(=O)N/N=C\c2cc([N+](=O)[O-])cc(C)c2O)c(C)c1 13955420 ZXMZDHHCDBRVHR-OCKHKDLRSA-N 357.366 2.755 50 40 FFGB CC(C)(C)NC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 409004272 BRAHZRWDVBOGRI-FYJGNVAPSA-N 353.422 2.630 50 40 FFGB COc1cc(/C=N/NC(=O)CNc2ccc(F)cc2)cc(Cl)c1O 409342947 CKHPSTPAQUHYKJ-DNTJNYDQSA-N 351.765 2.756 50 40 FFGB Cc1ccc(C(=O)N/N=C(\CCC(=O)O)c2ccccc2)cc1[N+](=O)[O-] 4646916 CYUZABCIQFMNRA-XDJHFCHBSA-N 355.350 2.902 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN(c2cccc(C)c2C)S(C)(=O)=O)cc1 408906530 GRSZCUFBCRWQRV-UDWIEESQSA-N 373.478 2.528 50 40 FFGB O=C(COc1ccc(Br)cc1)NNC(=O)C1CCCCC1 5616151 JMQPMIDYSVLEPR-UHFFFAOYSA-N 355.232 2.556 50 40 FFGB O=C(Oc1cccc(/C=N/NC(=O)[C@H](O)c2ccccc2)c1)c1ccco1 1425015 IAQPIFFLKUNVEF-KOMLCTQHSA-N 364.357 2.683 50 40 FFGB O=C(NC(=S)NNC(=O)c1cccs1)c1ccc2ccccc2c1 2592919 UCAFGOTYABSTRQ-UHFFFAOYSA-N 355.444 2.851 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)COc2cccc(C)c2)c2ccccc21 5739150 GKRFJHPXTJSGQK-QOCHGBHMSA-N 351.406 2.651 50 40 FFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1 38536882 CPONQNKAJJUPOH-QDDJLWQGSA-N 356.422 2.840 50 40 FFGB COc1ccccc1NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C 15423064 ZGICYZFMDUZTCF-AWEZNQCLSA-N 371.275 2.950 50 40 FFGB O=C(N/N=C/c1ccco1)C(=O)Nc1ccc(OCc2ccccc2)cc1 59444731 UYDFNFWUSFQROL-FYJGNVAPSA-N 363.373 2.947 50 40 FFGB C=CCN1C(=O)/C(=N/NC(=O)COc2ccc(Cl)cc2)c2ccccc21 103386164 LURWYHYOGSTCAJ-RELWKKBWSA-N 369.808 2.772 50 40 FFGB O=C(NNC(=S)Nc1ccccc1)c1ccc(NC(=O)C2CC2)cc1 674446 XYAPFDKDZDKDEB-UHFFFAOYSA-N 354.435 2.667 50 40 FFGB COc1ccccc1NCC(=O)NNC(=O)c1csc2c1CC[C@H](C)C2 12533040 AZZOMQMPVZSMPX-LBPRGKRZSA-N 373.478 2.755 50 40 FFGB Cc1ccc(S(=O)(=O)/C(C#N)=C\c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 35169603 FWZWVFYNNOYSEY-NSIKDUERSA-N 372.358 2.970 50 40 FFGB COC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cc(OC)ccc1O 2357799 XGALPYGWESRRSX-UKTHLTGXSA-N 352.346 2.733 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 408965365 KSFPKAWLRPGJIW-VXLYETTFSA-N 367.317 2.892 50 40 FFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(F)cc1 408907706 OYBAWRJCCWNUSQ-RSZPVBOMSA-N 357.385 2.633 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1Nc1ccccc1F 408709027 WNPUSODXGOFQII-SSDVNMTOSA-N 374.803 2.975 50 40 FFGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1cccnc1 2324054 SHZPOQMEYFAGOU-VIFPVBQESA-N 354.193 2.617 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2cc3c(s2)CCCC3)c1 3556724 MIUQUBYXXWJPGN-UHFFFAOYSA-N 360.435 2.719 50 40 FFGB COc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(F)cc2)cc(OC)c1O 3588668 GNVVHDQYCGYPAZ-VGOFMYFVSA-N 363.366 2.887 50 40 FFGB N#C/C(C(=O)NC1CCCC1)=C1/N=C(NC(=O)c2ccco2)c2ccccc21 5205341 VAMUVSQXODKOQH-VLGSPTGOSA-N 374.400 2.763 50 40 FFGB CCOC(=O)COc1cccc(/C=N/NC(=O)Cc2ccc(C)cc2C)c1 20195072 UDGCPDXFHYTMSL-LPYMAVHISA-N 368.433 2.938 50 40 FFGB N#C/C(=C/c1ccccc1)C(=O)NC[C@@H](c1cccs1)N1CCOCC1 98004273 VNKNSANDDWLLNW-FDWYHIAWSA-N 367.474 2.845 50 40 FFGB CC(C)(C)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 32904264 PERZWOSHVRUFPG-UHFFFAOYSA-N 363.421 2.741 50 40 FFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1ccco1 408972075 PTEIZOMJQBNAHR-RHLNUJDMSA-N 371.437 2.648 50 40 FFGB COc1ccc2c3c1O[C@@H]1[C@H](Br)C=C[C@@H]4[C@H](C2)N(C)CC[C@]341 16889934 HUJIUABKBDAGKG-QQCQHEPOSA-N 362.267 2.904 50 40 FFGB CC(=O)Nc1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1 32719985 XQJQVIFVPBCDPW-UHFFFAOYSA-N 363.373 2.579 50 40 FFGB C[C@@H](SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1)C(=O)N(C)c1ccccc1 12622471 SKLFTOMMQHVGHQ-OCCSQVGLSA-N 368.462 2.802 50 40 FFGB Cc1cc(C)nc(NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)n1 11333506 OZCLUKAPSFAJHZ-UHFFFAOYSA-N 369.469 2.654 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1ccc(N2CCCC2)cc1 4782810 BZYVIEFPVNKCMT-DEDYPNTBSA-N 368.393 2.724 50 40 FFGB O=C(N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1)c1ccccc1O 7910886 OJSWTZKNQZPEMJ-XDHOZWIPSA-N 350.334 2.855 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2ccccc2F)cc1 100522571 PWWWTACPRPURMD-LPYMAVHISA-N 357.385 2.647 50 40 FFGB CC1(C)OC(=N)C=C1n1c(=O)n(/C(=C/C#N)C(C)(C)O)c2ccccc21 16577125 XFVPPEQJVXDBPH-ICZFKYGZSA-N 352.394 2.565 50 40 FFGB CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)c3ccc[n+]([O-])c3)cc2C1 8393557 SDSSQKMCNTVSKI-AWEZNQCLSA-N 373.478 2.607 50 40 FFGB CCC(/C=N/NC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)CC 24035653 IOFXJSWONAQOLS-QGOAFFKASA-N 353.488 2.869 50 40 FFGB COc1ccc2cc(C(=O)NNC(=O)c3ccccc3F)c(C)nc2c1 27068247 NZEFSJZTPWTAEC-UHFFFAOYSA-N 353.353 2.766 50 40 FFGB CCC(=O)Nc1ccc(C(=O)N/N=C\c2ccc(OC)cc2OC)cc1 4534610 RAAWCOXSZLREBG-NDENLUEZSA-N 355.394 2.816 50 40 FFGB NC(=O)c1cc2c(ccc3ccccc32)o/c1=N/NC(=O)c1ccccc1 1510157 INHMEOGDACAECR-DARPEHSRSA-N 357.369 2.931 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OC(C)=O 6822235 JHJDBJBHGRKTPJ-YVLHZVERSA-N 350.374 2.844 50 40 FFGB CCCCCCCC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1 100169935 RETCEYKZHSYTKF-UHFFFAOYSA-N 352.431 2.834 50 40 FFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(OC)c3)[C@@H]2C1 4453466 WPUAPAGWLSTJBC-UXHICEINSA-N 373.460 2.831 50 40 FFGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc2c(c1)OCO2 408892538 CFNATKNWEIULTQ-WUXMJOGZSA-N 367.317 2.878 50 40 FFGB C[C@@]1(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)CC1(Cl)Cl 6016782 COVAEFJOWJKIEW-HNNXBMFYSA-N 366.204 2.955 50 40 FFGB Cc1cc2c(cc1/C=N\NC(=O)COc1cccc3cccnc13)OCO2 409016477 UFUGPEWNUZLMOG-YVNNLAQVSA-N 363.373 2.801 50 40 FFGB Cn1c2[n+](c3sc4c(c3c1=O)CCCC4)[C@@H](CBr)CS2 51353971 SCDFZTFNXNXUJH-QMMMGPOBSA-N 372.333 2.808 50 40 FFGB CN(NC(=O)Cc1csc(NC(=O)c2ccco2)n1)c1ccccc1 14141728 TZOAWWKYDNEQGQ-UHFFFAOYSA-N 356.407 2.699 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2c(C)nn(CC(C)C)c2Cl)c(C)o1 7990841 VEEBYHQJQHMVOH-UHFFFAOYSA-N 352.822 2.786 50 40 FFGB Cn1cccc1C(=O)N/N=C1/C(O)=Nc2c(Br)cc(F)cc21 61466089 GBEDNLTYHQZNMO-UHFFFAOYSA-N 365.162 2.662 50 40 FFGB CCO[C@@H](C)n1nccc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402641 OMWSKAYNKKXXGQ-ZBEGNZNMSA-N 356.426 2.889 50 40 FFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(OC)c3)[C@@H]2C1 988985 WPUAPAGWLSTJBC-WOJBJXKFSA-N 373.460 2.831 50 40 FFGB O=C(N/N=C/c1cccc(Br)c1)C(=O)Nc1cccc(F)c1 3151143 VRWNYOSDHUDTNS-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1ccc(O)cc1 1410918 VHSDPODDRQBYMZ-MDWZMJQESA-N 354.362 2.964 50 40 FFGB C/C(NNC(=O)C1CC1)=C1/C(=O)N(c2ccccc2)N=C1c1ccccc1 112116332 XCPFGNHDBKTMRT-JXAWBTAJSA-N 360.417 2.742 50 40 FFGB CCOc1ccc(C(=O)N/N=C\c2ccc(O)c(OC)c2)cc1OCC 409313330 IPJIRJVFVYJZGO-NDENLUEZSA-N 358.394 2.962 50 40 FFGB CCC1=NN(C(=O)c2ccccc2)[C@@](C)(NNC(=O)c2ccccc2)C1 4018174 PXJFKGXQQOFJSH-HXUWFJFHSA-N 350.422 2.949 50 40 FFGB CC(C)Oc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)CCl 8390514 ZIOFCGMZEWFLKA-UHFFFAOYSA-N 374.890 2.826 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1cccc([N+](=O)[O-])c1 8017742 XXYJOGOQCQQVTQ-OAHLLOKOSA-N 360.329 2.654 50 40 FFGB N#C/C(=C\N1CCN(c2cccc(Cl)c2)CC1)C(=O)NCc1ccco1 12416248 RYFLZDQNFNZXFV-CCEZHUSRSA-N 370.840 2.779 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc1 3031267 DTJPBXROILQZPR-DEDYPNTBSA-N 370.409 2.970 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)N[C@H](C)c2ccccc2)c1 59501689 OKDRZJJZWSGNPD-HFITWMCCSA-N 351.406 2.579 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccccc2Cl)c1C 58913969 KMJYBNRXZQLTIC-UUYOSTAYSA-N 372.856 2.890 50 40 FFGB Cc1ccc(CC(=O)N/N=C/c2ccc(N3CCOCC3)c(F)c2)c(C)c1 20195382 JVLQHAQXOQBVFL-OEAKJJBVSA-N 369.440 2.972 50 40 FFGB COc1ccc(OC)c(/C=C(\C#N)C(=O)NCc2ccc3c(c2)OCO3)c1 409207747 YYWBKNYUQMKKBM-OVCLIPMQSA-N 366.373 2.656 50 40 FFGB N#C/C(C(N)=O)=C1/S[C@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 16758877 FKJOGNMPCRQPIO-URTGMZOISA-N 367.405 2.737 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)cc1 408866987 IGUSFUQPLIOIML-QXWLRXRCSA-N 358.438 2.905 50 40 FFGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)c1cc2cc([N+](=O)[O-])ccc2o1 408903877 ATYLSHIXBJHLBQ-IUXPMGMMSA-N 370.277 2.719 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c1 408952621 KTRZTCFVEMVFJK-UHFFFAOYSA-N 356.344 2.872 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cccnc2)cc1Cn1nc(C)cc1C 5171987 NWPAOPYIKABLBN-SSDVNMTOSA-N 363.421 2.716 50 40 FFGB Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)c1ccccc1 2132103 BZTRZYLEGHNKHG-UHFFFAOYSA-N 359.813 2.828 50 40 FFGB CC(=O)NN(c1ccccc1)[C@@H]1C[C@@H](C)N(c2ccccc2)N1C(C)=O 4131141 HTBSYNVMGJQISS-QRWLVFNGSA-N 352.438 2.933 50 40 FFGB C[C@@H](CC(=O)NNC(=O)CCc1ccccc1)CC(=O)Nc1ccccc1 4784725 BMDWDCHMZZYGKT-MRXNPFEDSA-N 367.449 2.822 50 40 FFGB CC(C)NC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(Cl)cc2)c1 6376307 OKZAWAPKWKBVMR-SRZZPIQSSA-N 373.840 2.894 50 40 FFGB CCN(C(C)=O)c1nc(/C=C(\C#N)c2nnc3n2CCCCC3)cs1 12620352 GAMDHYAYGQITAF-UKTHLTGXSA-N 356.455 2.898 50 40 FFGB Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NNC(=O)c1cccnc1 27756958 BYUTTYMRCLVPDV-UHFFFAOYSA-N 374.759 2.912 50 40 FFGB CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccc2nccnc2c1 2386109 DESZYBAXHBKNHR-RSFOSLOZSA-N 371.441 2.629 50 40 FFGB COc1cc(C=C(C#N)C#N)cc(I)c1OC(C)=O 2772763 VKZDLCSEZDZGMG-UHFFFAOYSA-N 368.130 2.656 50 40 FFGB CCCCOC(=O)c1ccc(NC(=O)CCNC(=O)[C@@H](C)Cl)cc1 8733246 FAJJZHGJXAUVTN-GFCCVEGCSA-N 354.834 2.716 50 40 FFGB CC[C@H](C)n1c(SCC(=O)/C(C#N)=C(/C)N)nc2ccccc2c1=O 104829101 AMQDJPPGIRJHAF-CDZMIXDFSA-N 356.451 2.785 50 40 FFGB O=C(Cc1ccccc1)NNc1ncnc2c1cnn2Cc1ccccc1 4370346 FYAUDIOYWNUNSW-UHFFFAOYSA-N 358.405 2.560 50 40 FFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\NNc1c(Cl)cc(Cl)cc1Cl 16694063 JUKGMVGZYKTRRI-UITAMQMPSA-N 371.611 2.944 50 40 FFGB COC(=O)c1cccc(CBr)c1B1OC(C)(C)C(C)(C)O1 725327047 VFDQYJDAJPLBRP-UHFFFAOYSA-N 355.037 2.667 50 40 FFGB CCc1cc2c(=O)n(CC(=O)N/N=C\c3ccc(Cl)cc3)cnc2s1 101088177 BFMBCRCMXULKTA-ZBKNUEDVSA-N 374.853 2.824 50 40 FFGB CCCSc1ccc(C(=O)[C@H](CO)NC(=O)C(Cl)Cl)cc1 1666431 VSFNICGGMBPUOL-NSHDSACASA-N 350.267 2.652 50 40 FFGB COc1ccccc1/C=C/C(=O)NCC(=O)N/N=C(\C)c1ccc(F)cc1 4587316 REPFKIRWBYFBIY-IVSAPZPHSA-N 369.396 2.504 50 40 FFGB biogenic O=C(NNC(=S)N[C@@H]1C[C@H]2CC[C@H]1C2)c1cc2ccccc2cc1O 104272700 RZYXNMQTKTXISR-HZUKXOBISA-N 355.463 2.843 50 40 FFGB C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)/C(C#N)=C\c2ccc(N(C)C)cc2)C1 6571140 PLAIMSXANCZSMY-NNVWJYBBSA-N 369.465 2.707 50 40 FFGB Cc1nn(C[C@@H](C)C(=O)NC2=C(C#N)CCC2)c(C)c1Br 6526406 ZJGJURPZHYIXCW-SECBINFHSA-N 351.248 2.976 50 40 FFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(N2CCOCC2)c(F)c1 409127467 CTSDYDIJJSJMBF-LPYMAVHISA-N 371.412 2.743 50 40 FFGB Cc1c(C(=O)N/N=C/c2c[nH]c3ccccc23)sc2ncnc(N)c12 408974140 VQDIMAVIERYMOC-QPJQQBGISA-N 350.407 2.827 50 40 FFGB Cc1ccc(-c2ccc(/C=N/NC(=O)CC3(C)OCCO3)o2)cc1[N+](=O)[O-] 408723346 SAFQDFLZRQFHJB-YBFXNURJSA-N 373.365 2.766 50 40 FFGB Cc1cc(OCC(=O)N/N=C2\C(=O)N(C)c3ccccc32)cc(C)c1Cl 30937363 PCKXSBWOXSSYDB-PYCFMQQDSA-N 371.824 2.833 50 40 FFGB O=C(CCl)N(c1ccc(Cl)cc1Cl)[C@H]1CCS(=O)(=O)C1 217380742 FFGGZNYCCXFSJA-VIFPVBQESA-N 356.658 2.752 50 40 FFGB CCOc1ccc([C@@H]2CC(=O)N3CN(C)CSC3=C2C#N)cc1OC 20238071 DPXAWTNSKFEZNM-ZDUSSCGKSA-N 359.451 2.739 50 40 FFGB Cc1cccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1 25056231 HISGHLUTTCODNS-UHFFFAOYSA-N 361.401 2.897 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2CC=C[C@H]12)N/N=C1\C[C@H]2CC=C[C@@H]12 13969000 KVMHVJCPUHROLG-IHVFLIJGSA-N 354.454 2.683 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)CNc2ccc(C)cc2)cc1[N+](=O)[O-] 1215487 CKNNACXEXYCHFV-DEDYPNTBSA-N 356.382 2.864 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCCC1)c1ccc(F)cc1 20211849 GMFCTIWFFZYYLH-UHFFFAOYSA-N 369.462 2.808 50 40 FFGB NNC(=O)c1ccc([C@H]2c3sc(=O)[nH]c3S[C@@H]3[C@@H]4CC[C@H](C4)[C@H]23)cc1 100972084 KJTWZWQRLVXAGM-DHGKCCLASA-N 373.503 2.692 50 40 FFGB Cc1ccccc1OCC(=O)N[C@@H](C(=O)N/N=C/c1cccs1)C(C)C 4680628 HDJREQUIMPNYAD-JLWFYQMASA-N 373.478 2.726 50 40 FFGB COc1c(Br)cc(/C=C(\C#N)C(N)=O)cc1Br 408758518 LQPBNQJGRNFCBF-FARCUNLSSA-N 360.005 2.612 50 40 FFGB CCO[C@H](C)n1nccc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402639 OMWSKAYNKKXXGQ-BZNIZROVSA-N 356.426 2.889 50 40 FFGB Cc1cc2c(c(=O)n1Cc1ccccc1)[C@H](c1cccnc1)C(C#N)=C(N)O2 1471900 NPWHBLHLFCMJHX-LJQANCHMSA-N 370.412 2.818 50 40 FFGB Cc1occc1C(=O)NNS(=O)(=O)c1cc(Cl)sc1Cl 20627700 IIGFVARAPRJCAK-UHFFFAOYSA-N 355.224 2.580 50 40 FFGB O=C(CCc1ccccc1)NNC(=O)COc1cccc(C(F)(F)F)c1 2663009 ZYTRRWSPRITTSL-UHFFFAOYSA-N 366.339 2.864 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O)C(C)(C)C 4491826 KWIGIOLMSMUBQK-GZTJUZNOSA-N 359.879 2.644 50 40 FFGB CCOc1cc(/C=N/NC(C)=O)ccc1OCC(=O)Nc1ccc(C)cc1 409012762 KLKZBXYUTLMWPV-CIAFOILYSA-N 369.421 2.881 50 40 FFGB N#CC1=C(N)Oc2c(ccc3c(O)cccc23)[C@@]12C(=O)Nc1ccccc12 36649122 RZYAFEKQNIAQGL-OAQYLSRUSA-N 355.353 2.870 50 40 FFGB O=C(CN1CCN(Cc2ccccc2)CC1)N/N=C\c1ccc(Cl)cc1 32576941 XBQIIOUSJZDXOR-HMAPJEAMSA-N 370.884 2.608 50 40 FFGB CNC(=O)/C(C#N)=C/c1c(Oc2cccc(C)c2)nc2c(C)cccn2c1=O 2377478 HVCBZOSZWBYUSF-RVDMUPIBSA-N 374.400 2.757 50 40 FFGB O=C(COc1ccc(N2CCCC2=O)cc1)Oc1ccc([N+](=O)[O-])cc1 102879665 MJJGAJDBDZXKGX-UHFFFAOYSA-N 356.334 2.706 50 40 FFGB COc1cc(C(=O)N/N=C/c2ccco2)ccc1I 4739619 GGQHGXRVDZZFKG-OVCLIPMQSA-N 370.146 2.657 50 40 FFGB COc1ccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc(Cl)cc2)cc1 8710110 FZSMZGWCNMABNE-UHFFFAOYSA-N 370.796 2.814 50 40 FFGB O=C(N/N=C\c1ccc2c(c1)OCO2)c1cc(Br)ccc1O 34705508 WAKLBJCNKLZDJN-IDUWFGFVSA-N 363.167 2.647 50 40 FFGB Cc1ccc(C)c(NCC(=O)N/N=C/c2ccc(N(C)C)c([N+](=O)[O-])c2)c1 4117052 ITIKHXKCMBSQLZ-SRZZPIQSSA-N 369.425 2.840 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)cc([N+](=O)[O-])c1O 59145580 PJZMJLTXIXOFCM-OVCLIPMQSA-N 367.361 2.922 50 40 FFGB CCOc1ccccc1NC(=O)CCNC(=O)[C@H](Br)CC 8733055 AVPLNFRZSNNODF-LLVKDONJSA-N 357.248 2.704 50 40 FFGB CCN1C(=O)/C(=N\NC(=O)c2cc(-c3ccccc3)n[nH]2)c2ccccc21 18043427 DMPZYPZSZZEAEI-NKFKGCMQSA-N 359.389 2.577 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1OC 13069961 MQIDHPNQKBKUSI-NTEUORMPSA-N 352.346 2.948 50 40 FFGB CC1=C(C#N)C(=O)N(C[C@H]2CCCO2)C(=O)/C1=C\Nc1ccccc1F 9050851 FGONVYMAJALKKX-NWFCWYBLSA-N 355.369 2.509 50 40 FFGB C/C(=N\NC(=O)CNc1ccc(F)cc1)c1ccc(-n2ccnc2)cc1 4863749 SDUYATFTCLOBND-OEAKJJBVSA-N 351.385 2.964 50 40 FFGB Cc1c(/C=N\NC(=O)c2cc([N+](=O)[O-])ccc2O)c2ccccc2n1C 408917749 ASXYQPAFNMJTHI-GRSHGNNSSA-N 352.350 2.864 50 40 FFGB CC1=C(C#N)C(=O)N(C[C@H]2CCCO2)C(=O)/C1=C\c1ccc(N(C)C)cc1 16753066 VGCFAKBJQIZZNB-LVSMMTLPSA-N 365.433 2.524 50 40 FFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1cccc([N+](=O)[O-])c1 35125405 QDRVOMKLWPQNAT-LICLKQGHSA-N 358.310 2.666 50 40 FFGB CC(C)(CCl)C(=O)N1CCCN(c2ccc3c(c2)OCCO3)CC1 12143949 KBBVPXFLWDWEKB-UHFFFAOYSA-N 352.862 2.762 50 40 FFGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1sc2c(c1C(=O)O)CCCC2 6233123 DKGXVXZVYIVKPS-UFWORHAWSA-N 360.439 2.735 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 59473185 TUYLXMXIWBMHFP-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB COc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)COc1c(C)cccc1C 1444627 WUFDJRYNOHAXGT-VXLYETTFSA-N 357.366 2.749 50 40 FFGB COc1cccc(NCC(=O)NNC(=O)c2csc3c2CC[C@H](C)C3)c1 8707300 IORTYXHWQDVUGI-LBPRGKRZSA-N 373.478 2.755 50 40 FFGB COc1ccc(NC(=S)NNC(=O)CNc2ccc(C)c(C)c2)cc1 408587944 VAAZSEMOVRTKIO-UHFFFAOYSA-N 358.467 2.742 50 40 FFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1 38536880 CPONQNKAJJUPOH-XMDNHAFTSA-N 356.422 2.840 50 40 FFGB CCn1nc(C(F)(F)F)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2 253399309 IWDMUWDXFGXQQD-ZDUSSCGKSA-N 352.316 2.737 50 40 FFGB CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)NCC1CCCC1 63606815 AOHWHYGEOTUNTH-UHFFFAOYSA-N 368.503 2.580 50 40 FFGB C[C@H]1CN(C(=O)NNC(=O)c2ccc(F)cc2)C[C@@H](c2ccccc2)O1 63182910 AUCXPYSMWZKHPX-GUYCJALGSA-N 357.385 2.642 50 40 FFGB COc1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)ccc1OCC(N)=O 8112917 AOTCAZUACUTSTO-ZSOIEALJSA-N 353.334 2.532 50 40 FFGB CCOC(=O)CC1=C(C(=O)OCC)[C@H](c2ccc(C)cc2)C(C#N)=C(N)O1 715140 IKLIFASPSYMKGE-QGZVFWFLSA-N 370.405 2.573 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3cccc(OC)c3oc2=N)cc1 57523728 WGPDKFWSNDGNME-MWGQCEDWSA-N 351.362 2.693 50 40 FFGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)Cn1ncc(Cl)c(Cl)c1=O)C2 58364441 RSZMNABJTILCFC-QOUOMYLKSA-N 371.268 2.869 50 40 FFGB C#CCOc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OCC 4570876 ACTSIWDLXYAYTB-IBGZPJMESA-N 364.401 2.912 50 40 FFGB Nc1ccc(C(=O)N/N=C2/C(=O)N(Cc3ccccc3)c3ccccc32)cc1 6790805 WPGCAQUYACOJMX-HIXSDJFHSA-N 370.412 2.950 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1cc(C)n(-c2ccccc2F)c1C 408973247 XUOAQKUFNJIIPF-CIAFOILYSA-N 358.417 2.552 50 40 FFGB CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc3c(c2)OCO3)cc1 408997931 PHBFRYPORRDIRB-SRZZPIQSSA-N 367.405 2.802 50 40 FFGB C/C(=N/NC(=O)CCC(=O)N/N=C(/C)c1ccccc1)c1ccccc1 16893058 PQRQNFMPMZRTLJ-BMJUYKDLSA-N 350.422 2.847 50 40 FFGB CCOC(=O)C1=C(CBr)N(C)C(=O)N[C@H]1c1ccc(C)cc1 12412393 PMTWSYPYPDTUFQ-AWEZNQCLSA-N 367.243 2.903 50 40 FFGB C/C(CC(=O)Nc1cccc([N+](=O)[O-])c1)=N\NC(=O)Cc1ccccc1 100923043 OVPKSESRFGIALA-DEDYPNTBSA-N 354.366 2.658 50 40 FFGB Cc1ccc(NCC(=O)N/N=C/c2cc(Cl)cc([N+](=O)[O-])c2O)cc1 36145060 ZAUKHAWQMPAQRW-UFWORHAWSA-N 362.773 2.824 50 40 FFGB O=C(NNC(=O)c1ccccc1-c1ccccc1C(=O)O)c1cccnc1 4673352 ORJCEBAVKYTITM-UHFFFAOYSA-N 361.357 2.522 50 40 FFGB COc1cccc2cc(C(=O)N/N=C/c3ccc(OCC(=O)O)cc3)oc12 4739965 RWHFZFZSYAGBRU-KEBDBYFISA-N 368.345 2.669 50 40 FFGB C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc2c(c1)OCO2 5894656 MNVZKHPELNASPR-LZYBPNLTSA-N 351.156 2.925 50 40 FFGB Cc1ccc(N(CC(=O)NN=C2CCCCC2)S(C)(=O)=O)c(C)c1 408779976 PADNNQRCIHIRDZ-UHFFFAOYSA-N 351.472 2.506 50 40 FFGB O=C(O)Cn1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c2ccccc21 409233916 INJAVDMHXLPRBK-FBHDLOMBSA-N 353.353 2.558 50 40 FFGB COc1ccc(/C=N\NC(=O)COc2ccc(Cl)cc2)cc1[N+](=O)[O-] 32189174 DMJTWYNIFKRGGS-NVMNQCDNSA-N 363.757 2.786 50 40 FFGB CCOc1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])ccc1OC 108036178 RYMPRYUDBNLPCL-UNOMPAQXSA-N 357.366 2.695 50 40 FFGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)OCC(=O)NC1CCCCCC1 3252777 GXJQRNAQHJUHBC-DHDCSXOGSA-N 370.405 2.704 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccccc1OC 408603288 FMPQWVFNAYZWCZ-HNNXBMFYSA-N 370.434 2.643 50 40 FFGB O=C(NNC(=O)c1ccccc1OC(F)(F)F)c1ccnc(Cl)c1 2577973 WFEPJDQIOKFYSK-UHFFFAOYSA-N 359.691 2.708 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1cccc(C)c1 4697796 CSJONFKCGVXRQU-HYARGMPZSA-N 367.405 2.901 50 40 FFGB Cc1cc(C)nc(NNC(=O)c2ccc(COCC(F)(F)F)cc2)n1 22471792 QRXYJXUEIYCWFM-UHFFFAOYSA-N 354.332 2.929 50 40 FFGB O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(F)c(F)c1 22626105 OTTNOODHYKXYDP-UHFFFAOYSA-N 374.265 2.824 50 40 FFGB C=CCOc1ccc(/C=N\NC(=O)Cc2ccc(OC)c(OC)c2)cc1 59515927 FPFNOZXSFQFIOJ-STZFKDTASA-N 354.406 2.961 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)C23CCC4C[C@H](C[C@@H](C4)C2)C3)cc1 102946328 VDZJRRIVPUYNRH-BWRBCVJASA-N 362.495 2.911 50 40 FFGB COc1ccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc1O 3515997 PNWHFMUMLKFUPV-LSFURLLWSA-N 367.327 2.982 50 40 FFGB N#C/C(=C/c1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ccccc1 66255722 MZSVQASPZPJMRJ-PDGQHHTCSA-N 365.408 2.886 50 40 FFGB CCc1ccc(CC(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 409363138 JTJARLKJXZDNGX-VXLYETTFSA-N 355.350 2.579 50 40 FFGB O=C(NNC(=O)c1cccs1)c1ccc(-c2cccc([N+](=O)[O-])c2)o1 19682149 MGWDMYQHVLKAFL-UHFFFAOYSA-N 357.347 2.991 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)c3ccc4ccccc4n3)ccc21 2627688 WYDGNRTYIBUURL-UHFFFAOYSA-N 373.416 2.988 50 40 FFGB CC1(C)[C@@H](O)[C@]2(Br)CC[C@]1(CC(=O)O)[C@@H]2Br 103708685 DRSFYJASRKYEEL-OEIWMXHLSA-N 356.054 2.539 50 40 FFGB O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(-c2ccccc2)cc1 3339620 FCEMEWRBURSODL-HXUWFJFHSA-N 374.396 2.955 50 40 FFGB COc1ccc(CC(=O)N/N=C/c2ccc(O)c(Br)c2)cc1 4544327 SIMIZCYBNLIZNZ-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB CN(C)C(=O)/C(C#N)=C/c1ccccc1OCc1ccc(C(=O)O)cc1 4705368 KDRJWKWSMPQKFP-GZTJUZNOSA-N 350.374 2.959 50 40 FFGB CCOc1ccc(C(=O)N/N=C\c2ccc(OC)c(OC)c2)cc1OC 409328140 ZQNQPKJKPFZZJJ-NDENLUEZSA-N 358.394 2.875 50 40 FFGB COC(=O)c1ccc(/C=N\NC(=O)COc2ccc(Cl)cc2C)cc1 30802460 XCXFYJFWWGFOCF-JMIUGGIZSA-N 360.797 2.964 50 40 FFGB Cc1cccc(C(=O)Nc2ccccc2C(=O)NNC(=O)c2ccncc2)c1 9749149 DFZWZWVXILJQCI-UHFFFAOYSA-N 374.400 2.717 50 40 FFGB Cc1cccc(/C=N/NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 7698947 SVPYLCJHTCQNCP-XSFVSMFZSA-N 371.462 2.543 50 40 FFGB COc1cccc(/C=N\NC(=O)[C@@H](C)Oc2cccc3cccnc23)c1O 32223177 LCRAEQORPSIKHJ-IKTNTUJMSA-N 365.389 2.867 50 40 FFGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C1=NN(c2ccccc2)[C@H](N)[C@H]1C#N 408903942 BMGUAXWNAZIKKJ-WMGIFWIASA-N 374.360 2.508 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cccc(Cn3cccn3)c2)c(OC)c1 1081686 MYXNODKABRDWKZ-FYJGNVAPSA-N 364.405 2.713 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc3c(c2)OCO3)c(C)c1 3084409 DEGAPAMOVVFEHA-SRZZPIQSSA-N 367.405 2.901 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccc4c(c3)OCO4)c2[C@@H]1c1ccc(O)cc1 6188198 QDIYNLUMYXOLLL-MRXNPFEDSA-N 374.356 2.729 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Cl)c1OCC(=O)O 4506817 YDZWOPVBMLFZEB-XGICHPGQSA-N 366.801 2.634 50 40 FFGB CC(C)N1C(=O)/C(=N\NC(=O)c2cc(Cl)ccc2O)c2ccccc21 5464270 ADSUABOVOBJGRT-SILNSSARSA-N 357.797 2.935 50 40 FFGB O=C(NNC(=O)c1cc2c(s1)-c1ccccc1OC2)c1cccnc1 7038975 AKCIQAPOHGGIRG-UHFFFAOYSA-N 351.387 2.777 50 40 FFGB Cc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc(F)cc3)CC2=O)cc1C 409153121 CQGBNJBJWCDZLB-RSFOSLOZSA-N 353.397 2.946 50 40 FFGB CCCc1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1 7907389 QNMHYFCFJDGHMC-UHFFFAOYSA-N 371.462 2.754 50 40 FFGB N#C/C(=C\c1cccn1Cc1ccccc1[N+](=O)[O-])C(=O)N1CCCC1 409370564 AQRIIKXYYWWWDG-FOWTUZBSSA-N 350.378 2.974 50 40 FFGB Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNc1ncccn1 48234703 RVDOXINZZGJDND-UHFFFAOYSA-N 356.817 2.618 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)cc([N+](=O)[O-])c1O 36387113 AIAUHSYJCBQXCZ-IZZDOVSWSA-N 357.297 2.994 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(F)cc2)c1 408609189 JOZKVWGFIKFTEH-OFJBCHTGSA-N 371.412 2.770 50 40 FFGB CCOc1ccc([C@@H](O)CCC(=O)N/N=C/c2ccc(N(C)C)o2)cc1 83301680 OSIZXSRBOIMRDT-NNIWKIFQSA-N 359.426 2.708 50 40 FFGB N#C/C(=C\c1ccc(C(=O)O)cc1)C(=O)N1CCN(c2ccccc2)CC1 13344219 CNRXMFQYXBZJNX-NBVRZTHBSA-N 361.401 2.641 50 40 FFGB O=C(Cc1cccs1)N/N=C\c1ccc(I)o1 4724426 CSVBUNYLQGVIFE-QPEQYQDCSA-N 360.176 2.639 50 40 FFGB O=C(CSc1ccc(Cl)cc1)NNC(=O)c1ccc2[nH]cnc2c1 12602942 LZYDBOXAYRAGJL-UHFFFAOYSA-N 360.826 2.770 50 40 FFGB COc1ccc(NC(=S)NNC(=O)c2ccccc2OC(F)F)cc1 13858336 HMZOJYXVUBOFGZ-UHFFFAOYSA-N 367.377 2.928 50 40 FFGB Cc1cc(C)cc(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)c1 8474871 DRFLLNFZSRTEEU-MTWVNVMRSA-N 364.239 2.813 50 40 FFGB O=C(N/N=C\c1ccc(O)c(Br)c1)c1ccc2c(c1)OCO2 32116957 RFXQUQIKTUQVIN-IDUWFGFVSA-N 363.167 2.647 50 40 FFGB CCS(=O)(=O)[C@@H](I)[C@H](O)c1cccc(Cl)c1 96519237 KAADRHASOWQEQP-NXEZZACHSA-N 374.627 2.569 50 40 FFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)[C@@H](OC)c2ccccc2)cc1 100923048 FORUNVDEJKXYOU-KWJZBXMYSA-N 369.421 2.904 50 40 FFGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccc2c(c1)OCO2 108904732 DPZQEOPMAUBWQN-LSHDLFTRSA-N 373.368 2.679 50 40 FFGB CN(C)c1ccc(C(=O)N/N=C/c2cc(Br)ccc2O)cc1 3151554 FWSQCQNWFHHGRG-VCHYOVAHSA-N 362.227 2.985 50 40 FFGB CCCCCn1nc(C(=O)NNC(=O)C2CCCC2)c2ccccc2c1=O 12691563 JOQXJJHWGUCQSS-UHFFFAOYSA-N 370.453 2.538 50 40 FFGB C[C@@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCl 408738634 SWIBMCYWVIHRME-HIFRSBDPSA-N 370.877 2.840 50 40 FFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1 409007142 TUSCCONLWGODDD-PXLXIMEGSA-N 365.433 2.698 50 40 FFGB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)c1ccoc1C 40128905 KZDYNUKEIDHNGE-UHFFFAOYSA-N 370.384 2.533 50 40 FFGB O=C(CCl)N(c1ccc(Cl)c(Cl)c1)[C@@H]1CCS(=O)(=O)C1 40177606 ODJWKANAUXJKEP-SECBINFHSA-N 356.658 2.752 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(Cl)ccc2O)n1 8336655 UVKRQOAOALYUCV-REZTVBANSA-N 350.831 2.695 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCC1)c1cccc2ccccc12 4502910 PGILOSFONLBICN-UHFFFAOYSA-N 359.451 2.652 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc[nH]n2)cc1COc1ccccc1F 5728344 LBOQQWKNCZZADC-SSDVNMTOSA-N 368.368 2.900 50 40 FFGB COc1ccc(C(=O)NNC(=O)c2cnn(-c3cccc(C)c3)c2C)cc1 29553946 KTCJVYACQFOXGP-UHFFFAOYSA-N 364.405 2.573 50 40 FFGB COc1ccc(Br)cc1/C=C1\C(=O)N(C)C(=O)C(C#N)=C1C 16750084 KRTLKOSJJYZTTD-GHXNOFRVSA-N 361.195 2.680 50 40 FFGB CC(C)CNC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(F)cc2)c1 408611166 QAMQVVNTAITEOC-FSJBWODESA-N 371.412 2.627 50 40 FFGB O=C(CN[C@@H](c1ccccc1F)C1CCCC1)NNC(=O)c1ccco1 95985923 UJCJETYPEPWLJR-GOSISDBHSA-N 359.401 2.701 50 40 FFGB COC(=O)c1cccc(-c2ccc(/C=C(\C#N)c3n[nH]c(N)c3C#N)o2)c1 5610914 AWLMQGHEWOSEPS-MDWZMJQESA-N 359.345 2.974 50 40 FFGB Cc1nn(CC(=O)N/N=C/c2ccc(Cl)cc2Cl)c(C)c1[N+](=O)[O-] 5151301 JMOJZDMOOWZOIZ-UBKPWBPPSA-N 370.196 2.865 50 40 FFGB COc1ccccc1C(=O)NNC(=O)COc1ccc2ccccc2c1 829238 FWGVGWHXLYWCPY-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB CC(=O)N/N=C/c1cccn1-c1ccc(I)cc1 2730187 DQGCJDVGAYCEIM-OQLLNIDSSA-N 353.163 2.552 50 40 FFGB Cc1ccc([C@H]2CC(=O)NC(SCC(=O)NCC(C)C)=C2C#N)cc1 6477683 UEHUPUIDVCJCFM-OAHLLOKOSA-N 357.479 2.839 50 40 FFGB COC(=O)[C@]12CC[C@](CBr)(C(=O)[C@@H]1Br)C2(C)C 109275160 PVYFESIMHVMBHV-QILRFPOHSA-N 368.065 2.693 50 40 FFGB O=C(CCc1c[nH]c2ccccc12)NNC(=O)Cc1c[nH]c2ccccc12 6787786 BCUQIBUISFFBEI-UHFFFAOYSA-N 360.417 2.972 50 40 FFGB CC1(C)[C@@H](O)[C@@]2(Br)CC[C@@]1(CC(=O)O)[C@@H]2Br 216528910 DRSFYJASRKYEEL-SCVMZPAESA-N 356.054 2.539 50 40 FFGB COc1cc(/C=N\NC(=O)COc2ccccc2Cl)ccc1OCC#N 33407130 BWLCRSGCMBUVQA-NHDPSOOVSA-N 373.796 2.780 50 40 FFGB Cc1ccc(N2C(=O)[C@H]3SC(N)=C(C#N)[C@H](c4ccco4)[C@H]3C2=O)cc1 100165559 GHPDSTAHLAOERL-OAGGEKHMSA-N 365.414 2.671 50 40 FFGB N#CC(C(=O)COC(=O)c1cccnc1Cl)=C1Nc2ccccc2N1 2657695 SLDUSNWBZNSHIX-UHFFFAOYSA-N 354.753 2.734 50 40 FFGB CCOC(=O)CC1=C(C(=O)OCC)[C@@H](c2ccc(C)cc2)C(C#N)=C(N)O1 715139 IKLIFASPSYMKGE-KRWDZBQOSA-N 370.405 2.573 50 40 FFGB O=C(N/N=C/c1ccccc1C(F)(F)F)C(=O)Nc1ccccc1F 59434089 QPMJOIMIADUCMV-ZVBGSRNCSA-N 353.275 2.933 50 40 FFGB CCOc1cc(/C=N/NC(=O)CNc2ccc(C)cc2)cc([N+](=O)[O-])c1O 36223306 ZRTDFVFABKQBDD-KEBDBYFISA-N 372.381 2.570 50 40 FFGB O=C(CSc1nc2ccccc2s1)NNC(=O)Cc1ccccc1 5772905 TVKAZGBBUIXOMO-UHFFFAOYSA-N 357.460 2.779 50 40 FFGB Cc1ccccc1C[C@H]1S/C(=C(\C#N)C(N)=O)N(c2ccccc2)C1=O 2376704 WTIFUCLUFDINKP-PBEQFFAXSA-N 363.442 2.907 50 40 FFGB CCCCNC(=O)CSC1=C(C#N)[C@@H](c2ccc(OC)cc2)CC(=O)N1 6323108 NFXMUQDEQXSSGL-OAHLLOKOSA-N 373.478 2.683 50 40 FFGB CCn1cc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)c2ccccc21 6948198 NVPRALLJLAGSCP-LSHDLFTRSA-N 364.405 2.952 50 40 FFGB C/C(=N/NC(=O)c1ccccn1)c1ccc(NC(=O)C(F)(F)F)cc1 5381334 DTKJEAQZGHIBRZ-YVNNLAQVSA-N 350.300 2.736 50 40 FFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)cc1 408612334 VBFJKKJAVRDQDP-FSJBWODESA-N 371.412 2.627 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(C)c(Cl)c1)S(C)(=O)=O)C(C)(C)C 408782400 GSCKXJYESXQVFL-LDADJPATSA-N 373.906 2.953 50 40 FFGB O=C(CCl)N1CC[C@@H](CN(C(=O)OCc2ccccc2)C2CC2)C1 79412093 ADOJEUOCOVEFMK-OAHLLOKOSA-N 350.846 2.875 50 40 FFGB CCc1ccccc1NC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br 102538991 PZTJVLUTSZLBNQ-DKJTXKKOSA-N 364.239 2.759 50 40 FFGB O=C(NNC(=O)c1ccc(Cl)nc1)c1ccc(Br)cc1 2630494 MLACBVVDYGHXMD-UHFFFAOYSA-N 354.591 2.572 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccc4c(c3)OCO4)c2[C@H]1c1cccc(O)c1 9704016 XFRMYHQHDHNOSX-INIZCTEOSA-N 374.356 2.729 50 40 FFGB Cc1ccc(/C=C/C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl 12781559 PEBPGAKCMWWTCM-IJDCCNJMSA-N 372.808 2.649 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)c2cc3cc(OC)ccc3[nH]2)c1 2433417 FPVNDGGNIVKHHO-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB O=C(NNC(=O)C1CCCCC1)c1ccccc1I 6258505 RWOWJUBMXLEAFZ-UHFFFAOYSA-N 372.206 2.633 50 40 FFGB C/C(=N\NC(=O)CNc1ccccc1)c1ccc(N2CCOCC2)c(F)c1 7009013 HCRCSKIJPOOEQN-HZHRSRAPSA-N 370.428 2.615 50 40 FFGB O=C(NCc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1cccs1 4199166 SUXVLRNRTMHUIF-QGMBQPNBSA-N 356.234 2.821 50 40 FFGB O=C(N/N=C1\C(=O)Nc2ccc(Br)cc21)Nc1ccccc1 15773585 CUIDXYGBIFUFAX-UHFFFAOYSA-N 359.183 2.927 50 40 FFGB Cc1ccc(NCC(=O)N/N=C/C=C/c2cn(Cc3ccccc3)nn2)cc1 17414334 DVWTUIOLHILMHJ-PBWYYWLFSA-N 374.448 2.862 50 40 FFGB COc1cccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)c1OC 2801718 VMHPLJOPFMFUBB-GXDHUFHOSA-N 352.346 2.948 50 40 FFGB Cc1cccc(C(=O)NNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)c1 12406170 UPKPGVVOALWGNS-GOSISDBHSA-N 354.406 2.628 50 40 FFGB CC1(C)Cc2c(cnn2-c2ccccc2)C(=O)/C1=N/NC(=O)c1cccnc1 100590558 HWPVTGUXEMOTLE-CLCOLTQESA-N 373.416 2.818 50 40 FFGB CCN(CC)c1ccc(C(=O)NNC(=O)c2[nH]c(C)c(C(C)=O)c2C)cc1 32969042 UAGZDTDDBBJUCF-UHFFFAOYSA-N 370.453 2.755 50 40 FFGB O=C(Cc1c[nH]c2ccccc12)N/N=C/c1ccc(N2CCOCC2)s1 40161336 IYUWMKYMWKKRMC-FYJGNVAPSA-N 368.462 2.759 50 40 FFGB CC[C@@H](C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccccc1 2035078 LHZNWNGPOBMHCK-OAHLLOKOSA-N 372.421 2.667 50 40 FFGB CC[C@H](Oc1ccc(C)cc1)C(=O)NNC(=O)c1ccc(OC)c(OC)c1 12137398 VZXALKHQSKAUSH-INIZCTEOSA-N 372.421 2.631 50 40 FFGB Cc1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1 6841568 ZGLDXQUZZFABFF-ZDUSSCGKSA-N 362.813 2.642 50 40 FFGB COc1ccccc1OCC(=O)N/N=C\c1cn(CC#N)c2ccccc12 409370278 OBSVRCJVABFYHD-UUYOSTAYSA-N 362.389 2.703 50 40 FFGB Cc1ccc(S[C@H](C)C(=O)N/N=C2/C(=O)N(C)c3ccccc32)cc1 409339313 TYZNNTKOXUDLBZ-HZDTVXMRSA-N 353.447 2.973 50 40 FFGB CCOc1ccc(-c2cc(C(=O)N/N=C\c3cccnc3)[nH]n2)cc1OC 30735439 LGKPMFWUPYOGCM-MTJSOVHGSA-N 365.393 2.643 50 40 FFGB CC(C)c1ccc(CNC(=O)C(=O)N/N=C/c2cc(Cl)ccc2O)cc1 409248593 DYWPRDAACPETLK-SSDVNMTOSA-N 373.840 2.936 50 40 FFGB CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)NCCOC)o2)cc1 5007778 ONBWZDQZPRMDJR-FOWTUZBSSA-N 368.389 2.793 50 40 FFGB COc1ccc(/C=N\NC(=O)COc2cccc(C)c2C)cc1[N+](=O)[O-] 30838771 PUUJGPQLPQLOMH-GRSHGNNSSA-N 357.366 2.749 50 40 FFGB CCCc1nc(SCC(=O)NNC(=O)CC)c2c(C)c(C)sc2n1 4241159 GORPYTGSDLYQJI-UHFFFAOYSA-N 366.512 2.910 50 40 FFGB O=C(CC(=O)N/N=C/c1ccc(Cl)c(Cl)c1)NCc1cccnc1 59461577 JLKGKHQDEHTWFK-UFFVCSGVSA-N 365.220 2.545 50 40 FFGB CCCn1nc(C(=O)N/N=C/c2cccc(OC)c2)c2ccccc2c1=O 6785953 KWTSHUPYIPVUCJ-FYJGNVAPSA-N 364.405 2.579 50 40 FFGB Cc1cc(Cl)c(C)c(S(=O)(=O)NNC(=O)c2ccco2)c1Cl 7519757 RULFXKOBUCHRHR-UHFFFAOYSA-N 363.222 2.827 50 40 FFGB C[C@H](Sc1nc2ccccc2[nH]1)C(=O)N/N=C/c1ccc(O)cc1O 673203 YLEJRFUCYXQELE-NTOSSWPYSA-N 356.407 2.605 50 40 FFGB CCOc1ccc(N[C@H](C)C(=O)N/N=C/c2cccc(OC)c2O)cc1 695600 VKKOVZDJUTUFJG-HMHKGCENSA-N 357.410 2.750 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1ccc(OCc2ccc(C(=O)O)cc2)cc1 59333883 OVLAYBQPRWHKNP-BOPFTXTBSA-N 350.374 2.959 50 40 FFGB CCSC1=C(C#N)[C@@H](c2ccccc2[N+](=O)[O-])[C@@H](C(=O)OC)C(O)=N1 841864 OWZPJQRAKBMHDO-CHWSQXEVSA-N 361.379 2.926 50 40 FFGB O=C(N/N=C/c1ccccc1Cl)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 409151758 BZJKPYTWQBFUJY-WVISFHDSSA-N 359.788 2.982 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N\NC(=O)Cc1ccc(C)cc1 409359992 CUUGVUFQCFLXBS-ODLFYWEKSA-N 357.366 2.613 50 40 FFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1ccco1 408972073 PTEIZOMJQBNAHR-KKJJZKEWSA-N 371.437 2.648 50 40 FFGB O=C(O)COc1ccccc1P(=O)(c1ccccc1)c1ccccc1 68600126 YASCKQPLMKMQMW-UHFFFAOYSA-N 352.326 2.789 50 40 FFGB biogenic COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(N)=O)cc1OC 33405213 URNNUKJALGRSLH-GDNBJRDFSA-N 374.400 2.949 50 40 FFGB N#Cc1ccc(C(=O)NNC(=O)N2CCC[C@@H]2Cc2cccc(F)c2)cc1 60993205 UZJASZLWWPVYQT-GOSISDBHSA-N 366.396 2.759 50 40 FFGB CCOc1cc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)ccc1O 1241132 HWTWYGUTJNJHIV-VXLYETTFSA-N 370.434 2.910 50 40 FFGB CC[C@H]1CCc2sc(C(=O)NNC(=S)NC[C@@H]3CCCO3)cc2C1 7974445 VLXIWWWCXHZMOL-AAEUAGOBSA-N 367.540 2.551 50 40 FFGB CC(C)(C)c1ccc(S(=O)(=O)NNC(=O)Cc2cccs2)cc1 199417885 RDGBSIDMHPPBCF-UHFFFAOYSA-N 352.481 2.598 50 40 FFGB O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1ccc2c(c1)OCO2 854888 RJHNWHGKYNTOPX-QGMBQPNBSA-N 354.391 2.534 50 40 FFGB Cc1c(/C=N/NC(=O)Cc2ccc3c(c2)OCCO3)c2ccccc2n1C 409366365 UPWPUZCWHURAMG-LPYMAVHISA-N 363.417 2.951 50 40 FFGB O=C1NC[C@H](c2ccccc2)[C@H]1C(=O)N/N=C/c1ccc2ccccc2c1 4322468 URMMYKMQBMBWSI-LZQBXUBRSA-N 357.413 2.820 50 40 FFGB N#Cc1ccccc1OCC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 5578982 CYVFMYPDMJWACJ-UHFFFAOYSA-N 367.449 2.691 50 40 FFGB O=C(NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc2ccccc2n1 5669538 YRVWPWUVNRNEME-UHFFFAOYSA-N 353.294 2.808 50 40 FFGB O=C(NNC(=O)c1n[nH]c2ccccc12)c1cc2c(s1)CCCCC2 7943158 BICNUXHIZSVIRO-UHFFFAOYSA-N 354.435 2.968 50 40 FFGB CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)CCl)cc1 8390436 WZPSCUSEHAZIHL-UHFFFAOYSA-N 352.843 2.685 50 40 FFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCc1ccc([N+](=O)[O-])cc1 408886810 MJCCORDLTJUJMR-VXLYETTFSA-N 358.354 2.575 50 40 FFGB COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2ccc([N+](=O)[O-])cc2)c1 408867386 JUMRAPPGXKQFCR-RIYZIHGNSA-N 353.334 2.575 50 40 FFGB CCSS(=O)(=O)c1ccc(N/C=C2\SC(=S)NC2=O)cc1 584906248 JTXXGFINTRMFPU-YFHOEESVSA-N 360.507 2.530 50 40 FFGB COc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2)ccc1OCC#N 6170121 UDXUNGPDHXWMDX-SRZZPIQSSA-N 373.796 2.780 50 40 FFGB COc1cc2c(cc1/C=N/NC(=O)c1ccc(N3CCCC3)cc1)OCO2 7386657 FQUPQEDKVFAQNG-CIAFOILYSA-N 367.405 2.788 50 40 FFGB C/C(=N\NC(=O)c1ccccc1O)c1c(C)nn(-c2ccccc2)c1O 408723393 VFGQJMKTDMZEFV-UDWIEESQSA-N 350.378 2.746 50 40 FFGB COC(=O)[C@H](CNC(=O)[C@H](C)Br)Cc1ccc(Cl)cc1 95097987 AVRVVAQZADXCHM-ONGXEEELSA-N 362.651 2.571 50 40 FFGB N[C@@H](CSCc1ccc(N(CCCl)CCCl)cc1)C(=O)O 2043556 JBBJXJJIYKNJFV-ZDUSSCGKSA-N 351.299 2.616 50 40 FFGB CC(C)=NO[C@@]1(c2ccc(Cl)cc2)OC(N)=C(C#N)C1=C(C#N)C#N 100257448 SQOXMGCKHSBZRF-QGZVFWFLSA-N 353.769 2.973 50 40 FFGB O=C(COC(=O)c1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1 3523715 IZFITBSEDFMJPB-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB CC(C)CNC(=S)NNC(=O)c1cccc(OC(F)(F)C(F)F)c1 2794344 SWWRKTUIWJPZER-UHFFFAOYSA-N 367.368 2.688 50 40 FFGB Cc1cccc(C)c1OC[C@H](C)NC(=O)NNC(=O)c1ccc(C#N)cc1 58161379 RMNMLZXZVZSUCM-HNNXBMFYSA-N 366.421 2.587 50 40 FFGB CCOc1cc(Br)c(/C=C(/C#N)C(=O)N(C)C)cc1OC 59334379 ZMCMSPXSWPWYHX-WDZFZDKYSA-N 353.216 2.852 50 40 FFGB COc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)CSCc1ccccc1 20248813 JPRZMPZJSKZQNE-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB COc1cccc(/C=N\NC(=O)Nc2ccccc2)c1O[C@H](C)C(=O)O 409234955 BIQUEDQGYFQCFP-ZDFPAGSVSA-N 357.366 2.703 50 40 FFGB COc1cccc(/C=N/NC(=O)c2cc3c(OC)cccc3[nH]2)c1OC 2227959 YJBQFUAUUSSGAD-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB O=C(N/N=C/c1cc2cc3c(cc2nc1Cl)OCO3)c1ccncc1 5577173 MABIJCBJEDXHLX-DNTJNYDQSA-N 354.753 2.776 50 40 FFGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C1=NN(c2ccccc2)[C@@H](N)[C@H]1C#N 408903939 BMGUAXWNAZIKKJ-BPLJGICASA-N 374.360 2.508 50 40 FFGB C=CCOC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1C(=O)OCC 40146084 GQLXQUPYJJPFDI-SDNWHVSQSA-N 351.362 2.685 50 40 FFGB CC1(C)C(=O)[C@@]2(Br)CC[C@]1(CC(=O)O)[C@@H]2Br 85398920 OUDQDORDQBJHEI-BKDNQFJXSA-N 354.038 2.747 50 40 FFGB O=C(CCC(=O)N/N=C/[C@@H]1C[C@@H]2CC[C@@H]1C2)N/N=C/[C@@H]1C[C@@H]2CC[C@@H]1C2 225690940 NXDNIKYHOJFYMV-FLWODNTISA-N 358.486 2.843 50 40 FFGB N#CC1=C(N)Oc2ccc3ccc(=O)oc3c2[C@@H]1c1cccc([N+](=O)[O-])c1 5750107 JLYRDEYYMBXKBX-MRXNPFEDSA-N 361.313 2.919 50 40 FFGB C/C(CC(=O)Nc1ccc(Cl)c(Cl)c1)=N\NC(=O)C[N+](C)(C)C 16957803 JRDQNDZOLXGERY-VXLYETTFSA-O 360.265 2.520 50 40 FFGB CN(Cc1ccc(F)cc1F)C(=O)NNC(=O)c1c[nH]c2ccccc12 40051409 IGOBDPFMLYKWFV-UHFFFAOYSA-N 358.348 2.933 50 40 FFGB O=C(CC(=O)N/N=C\c1ccccc1C(F)(F)F)NCc1ccccc1 4905620 VNAJQLBNJKVYGG-FMCGGJTJSA-N 363.339 2.862 50 40 FFGB COc1ccc([C@@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@H]24)[C@@H]3I)cc1 104120268 KJZGQLKFWYXPAD-OKDXSUHISA-N 370.186 2.774 50 40 FFGB N#CSc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c(F)c1 3399935 GBWZFKLILISUOI-UHFFFAOYSA-N 366.395 2.971 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)N/N=C\c1cc(O)ccc1[N+](=O)[O-] 36213739 JCCXDIPVZYJVAL-LSCVHKIXSA-N 363.757 2.791 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2cccc(NC(C)=O)c2)cc1OC 6312367 XOIHCLJZSYLDSP-CIAFOILYSA-N 355.394 2.816 50 40 FFGB O=C(N/N=C/c1ccc(O)c(Cl)c1)C(=O)Nc1ccccc1Cl 409163305 PHNREFBEHSZNRJ-QGMBQPNBSA-N 352.177 2.788 50 40 FFGB CCOC(=O)[C@H](CCC(=O)OC)P(=O)(c1ccccc1)c1ccccc1 102058449 KUUHDAROGPXGHH-SFHVURJKSA-N 374.373 2.885 50 40 FFGB C=CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2)nc2ccccn2c1=O 2426005 GEWARDAGKLMLSC-FYWRMAATSA-N 372.384 2.696 50 40 FFGB Cc1c(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc(C#N)n1C 5687562 KOLHIBSFPGLDJA-NUGSKGIGSA-N 363.343 2.786 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(C)cc2)c1C 408940944 OVTSNJJJLICZBX-OMBDHMDGSA-N 354.454 2.767 50 40 FFGB Cc1ccc(C(=O)N/N=C\c2cc3c(cc2Br)OCO3)o1 33336076 BYEMDSJUQXATDA-SOFYXZRVSA-N 351.156 2.843 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 33702709 PEELJAHMKPWPPC-MFOYZWKCSA-N 362.729 2.849 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@@H]1c1ccc2c(c1)OCO2 100214659 HUTQKRGXCYIZJB-MRXNPFEDSA-N 372.336 2.556 50 40 FFGB Cc1ccc(C)c(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1 102612216 ISDLBGMHZQLDRI-DKJTXKKOSA-N 364.239 2.813 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(OCC)cc2)cc1 59483756 AIRSDRQRWRYGKC-KGENOOAVSA-N 369.421 2.963 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C 104342123 QUEAUWBACCHVAK-JXAWBTAJSA-N 351.406 2.885 50 40 FFGB Cc1cc2c(c(=O)n1Cc1ccccc1)[C@@H](c1ccncc1)C(C#N)=C(N)O2 1471741 VTMMQXRFVLJFHI-IBGZPJMESA-N 370.412 2.818 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1Nc1ccccc1F 408706772 DLKGJGGKGYOUQS-UFFVCSGVSA-N 362.792 2.809 50 40 FFGB C=CCc1cccc(/C=N\NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1O 36648998 RUUNLBGGXZLJMR-ZDLGFXPLSA-N 370.321 2.701 50 40 FFGB COC(=O)C1=C[C@@H](Br)CCN1C(=O)OCc1ccccc1 217466695 VYXUDLMDPOUTKA-LBPRGKRZSA-N 354.200 2.849 50 40 FFGB CCOc1ccc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2)cc1 5465034 WMPQXRMNBTXFLS-CIAFOILYSA-N 359.813 2.505 50 40 FFGB Cn1c(SCC(=O)C(C#N)=C2Nc3ccccc3N2)nnc1C1CC1 7235596 BINSBAZADZKZQF-UHFFFAOYSA-N 352.423 2.626 50 40 FFGB C/C(=N/NC(=O)CSc1nc2ccccc2n1C)c1ccccc1O 1251604 KARRSQGOQZAMJL-NDENLUEZSA-N 354.435 2.911 50 40 FFGB COc1cc(Cl)cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])c1O 109160632 IKHHQKPXKSDXOF-NVMNQCDNSA-N 363.757 2.655 50 40 FFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)(C)C)c2C)c1 408969301 LFAWPGSMNHPBQJ-CIAFOILYSA-N 354.454 2.767 50 40 FFGB C[C@H]1CCc2sc(C(=O)NNC(=O)CC(C)(C)CC(=O)O)cc2C1 16478862 QPXMBZNETJPOEY-JTQLQIEISA-N 352.456 2.525 50 40 FFGB N#Cc1ccc(C=NNC(=O)c2ccc(Cn3cc(Cl)cn3)o2)cc1 17073249 NNPSZWFMGIFLNN-UHFFFAOYSA-N 353.769 2.813 50 40 FFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1ccccc1Cl 409228353 XSDSHIVVDJJEDD-FYJGNVAPSA-N 373.840 2.949 50 40 FFGB O=C(NNC(=O)c1ccc(Br)s1)c1cc(F)cc(F)c1 6649394 TVCCVXZLUIBUGN-UHFFFAOYSA-N 361.167 2.864 50 40 FFGB O=C1O[C@H]2[C@@H]3C[C@H]([C@@H](C(=O)Nc4ccc(Cl)cc4)[C@@H]13)[C@H]2Br 102539025 ADFGUJBAULKYEF-HKLHZYFVSA-N 370.630 2.850 50 40 FFGB C[C@H]1CCCN([C@H](C)CNS(=O)(=O)c2ccc(CCCl)cc2)C1 106528801 VZJLUSYXSDJNMO-LSDHHAIUSA-N 358.935 2.867 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(Cl)cc1 408605155 KSSDIAORFNIYLJ-CYBMUJFWSA-N 360.826 2.898 50 40 FFGB O=C(NNc1cccc(C(F)(F)F)c1)[C@@H]1CC(=O)N(Cc2ccco2)C1 68774103 SRWHDDFPGWOKGI-LLVKDONJSA-N 367.327 2.790 50 40 FFGB CCn1c(NNC(=O)c2c(F)cccc2Cl)nc2ccccc2c1=O 32904531 UZGPZTMIUVXVPK-UHFFFAOYSA-N 360.776 2.966 50 40 FFGB CC1(C)[C@]2(C(=O)NCC(F)(F)F)CC[C@@]1(C)C(=O)[C@H]2Br 7260344 XPYVXBMOLCPOGB-VSYUYLJXSA-N 356.182 2.824 50 40 FFGB O=C(N/N=C/c1ccccn1)C(=O)Nc1ccc(OCc2ccccc2)cc1 59444733 FFJDLZFSUDRJKM-OEAKJJBVSA-N 374.400 2.749 50 40 FFGB C[C@@H](NC(=O)/C(C#N)=C/c1cccc(OCC(=O)O)c1)c1ccccc1 408813709 NUZMKRWOASVKHV-NGWPFTMJSA-N 350.374 2.934 50 40 FFGB COc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1O 4735323 YQIOFGRDGNUANM-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 34966805 PEMHZVVFJQWUHK-RIYZIHGNSA-N 353.334 2.532 50 40 FFGB CSc1nccn1-c1ccc(C(=O)NNc2nc(C)cc(C)n2)cc1 42767515 PNMRLWVRXOMJJU-UHFFFAOYSA-N 354.439 2.758 50 40 FFGB Nc1nnc(CC(=O)N/N=C/c2ccc(-c3cccc(Cl)c3)o2)s1 2268965 RKAIUKZAFUSTGF-QGMBQPNBSA-N 361.814 2.727 50 40 FFGB Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NNC(=O)[C@H]2CCCO2)c1 32260084 CDBSDMXTIJDKDK-MRXNPFEDSA-N 361.829 2.688 50 40 FFGB COCc1c(C(=O)NNC(=O)c2cc(Cl)cn2C)oc2ccccc12 28720059 UZIQSZZTCCRCOL-UHFFFAOYSA-N 361.785 2.646 50 40 FFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/NNC(=O)c1ccc(O)cc1 5342526 MRDMNMQIGDEDRI-WOJGMQOQSA-N 364.405 2.550 50 40 FFGB COC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1ccc(OC)cc1 8995677 CNJYFQUVBQPHMW-SEYXRHQNSA-N 351.362 2.940 50 40 FFGB CC1(CC(=O)N/N=C/c2ccc(OC(=O)c3ccccc3)cc2)OCCO1 408772893 SFPBJVGDXRYQAZ-KGENOOAVSA-N 368.389 2.509 50 40 FFGB O=C(CN1C[C@@H](c2ccccc2)CC1=O)N/N=C/c1ccc(Cl)cc1 5902028 PGVGDPAUJMPVLB-XYHOIZSOSA-N 355.825 2.806 50 40 FFGB CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)CCl 2567654 BKSBJYSNALKVEA-ZDUSSCGKSA-N 355.818 2.821 50 40 FFGB in-vitro COc1ncccc1C(=O)NNC(=O)c1cc2c(s1)CCCCCC2 46543977 JAEYHMGCCTYTMA-UHFFFAOYSA-N 359.451 2.886 50 40 FFGB C=CCn1c(=O)c(C(=O)N/N=C/c2ccccc2F)c(O)c2ccccc21 100708794 IKISNSVFMZJGDT-WSDLNYQXSA-N 365.364 2.796 50 40 FFGB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCCCl)cc1OC 3899938 NSAXSRFYNKWWNX-HNNXBMFYSA-N 368.817 2.504 50 40 FFGB O=C(/C=C/c1ccco1)NNC(=O)COc1cccc(C(F)(F)F)c1 6333317 ARPQEEGLNHJHSZ-VOTSOKGWSA-N 354.284 2.538 50 40 FFGB Cc1ccc(Cl)c2c1NC(=O)/C2=N\NC(=O)c1cccc([N+](=O)[O-])c1 15015353 LDHXGMTXIOUEAG-UHFFFAOYSA-N 358.741 2.643 50 40 FFGB C/C(=N\NC(=O)CN(c1cccc(C)c1)S(C)(=O)=O)c1ccc(C)cc1 20060287 BLCQNEQICAPHQG-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB COc1ccccc1/C=N/NC(=O)CN1C(=O)c2cccc3cccc1c23 106664545 CZBQNUJUHGAOMV-WSDLNYQXSA-N 359.385 2.959 50 40 FFGB Cc1c(C)[n+](=O)c2c(n1O)[C@H](Br)CC[C@@H]2Br 104096681 PLANLDNZPQGAQC-SFYZADRCSA-N 353.034 2.923 50 40 FFGB COc1ccc(-c2cc(C(=O)N/N=C(\C)c3ccc(O)cc3O)[nH]n2)cc1 105497449 HVRLNBIWXHHUQY-RGVLZGJSSA-N 366.377 2.651 50 40 FFGB COc1cc(OC)c2cc(C(=O)N/N=C/c3ccccc3O)[nH]c2c1OC 2363183 ANEJEFGXPLEATA-KEBDBYFISA-N 369.377 2.663 50 40 FFGB C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12 14229511 YOCCCADDIPCNDL-GFCCVEGCSA-N 371.824 2.979 50 40 FFGB CCOC(=O)N1CCC(=NNC(=O)c2ccccc2Br)CC1 5444600 ORDHIZCORHLDKT-UHFFFAOYSA-N 368.231 2.787 50 40 FFGB CCOC(=O)N/N=C(/C)c1ccc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 18255020 OATKSAVZVHIREP-PAXPMQMASA-N 357.410 2.836 50 40 FFGB CCOc1ncccc1C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 5981325 MUFQYXDICKBWPR-UHFFFAOYSA-N 357.454 2.848 50 40 FFGB COc1cccc(OC)c1C(=O)NNC(=O)c1ccccc1-n1cccc1 1394334 XQXFXRVDYLCQTJ-UHFFFAOYSA-N 365.389 2.569 50 40 FFGB COC(=O)COc1cccc(/C=N/NC(=O)Cc2ccc(C)cc2C)c1 20195069 QIBPLKNRYODHEV-CIAFOILYSA-N 354.406 2.548 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc(Cl)c(OC)cc2OC)c(O)c1 409391028 HAKXGPHXCBVTOE-DJKKODMXSA-N 364.785 2.835 50 40 FFGB Cc1cc2c(c(=O)[nH]1)[C@@H](c1ccccc1Br)C(C#N)=C(N)O2 16994503 JUZKNQVSJQWZBH-ZDUSSCGKSA-N 358.195 2.664 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)c(Cl)c1 2661053 JDLPFGRCLDBLRD-UHFFFAOYSA-N 369.204 2.842 50 40 FFGB C[C@@]1(CCc2ccc(N(CCCl)CCCl)cc2)NC(=O)NC1=O 1558050 VLFIDJLUELONPV-INIZCTEOSA-N 358.269 2.501 50 40 FFGB CCCNC(=O)CSC1=C(C#N)[C@@H](c2ccc(Cl)cc2)CC(=O)N1 6324080 UHMUBIDFIRWRAB-CYBMUJFWSA-N 363.870 2.938 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)CCCOc2cccc(C)c2)c1 8379897 VBUGRKSLYNYYCN-UHFFFAOYSA-N 372.421 2.632 50 40 FFGB O=C(CSc1cc(Cl)ccc1Cl)NNC(=O)c1cccnc1O 12672345 HYWGBJHWHSHSAS-UHFFFAOYSA-N 372.233 2.647 50 40 FFGB O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc2c(s1)CCCCC2 3409047 BYDQLGOUCPRXLY-OAHLLOKOSA-N 372.446 2.618 50 40 FFGB Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NNC(=O)c1ccccn1 7909516 WKIZDLRKNLNCDS-UHFFFAOYSA-N 374.759 2.912 50 40 FFGB COc1ccc(CC(=O)NNC2=CC(=O)C[C@H](c3ccccc3)C2)cc1 408751490 PLEVWMVAEUNFKC-QGZVFWFLSA-N 350.418 2.889 50 40 FFGB COc1ccccc1NC(=O)NNC(=S)NCCCc1ccccc1 408585873 KFHQEBMLYHDXQH-UHFFFAOYSA-N 358.467 2.829 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(C)=O 408758556 MMKVFEPPBGECSF-YBFXNURJSA-N 371.349 2.683 50 40 FFGB CC(=O)c1cc2c(cc1N/C=C(/C#N)S(=O)(=O)c1ccccc1)OCO2 2380880 OBFJPFLYWGAYCB-UVTDQMKNSA-N 370.386 2.869 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1OC 5942704 QGTASXRJVZJCLW-VXLYETTFSA-N 373.365 2.693 50 40 FFGB NNC(=O)c1cn(C(=O)c2cccc(Br)c2)c2ccccc12 226366561 DHEKFMIJXPFXOI-UHFFFAOYSA-N 358.195 2.696 50 40 FFGB N#C/C(=C\c1ccc(O)cc1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 941910 FKYAMPRFDCKJCH-FMIVXFBMSA-N 367.430 2.977 50 40 FFGB COc1cc(/C=N\NC(=O)c2ccccc2N)cc(Br)c1O 408718813 LOPKNKDLFYBLHI-LSCVHKIXSA-N 364.199 2.509 50 40 FFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1ccc(C)cc1 409233851 UCXNHWXRRWWOBX-KGENOOAVSA-N 353.422 2.604 50 40 FFGB Cc1nn(CCC(=O)N/N=C/c2ccc(F)s2)cc1Br 252494255 NPTYFOJLCUTNAB-GIDUJCDVSA-N 359.224 2.695 50 40 FFGB C/C(CC(=O)Nc1ccc(Cl)cc1Cl)=N\NC(=O)c1cnccn1 100783600 TXGGRCYOIHKRKI-ZVBGSRNCSA-N 366.208 2.918 50 40 FFGB CCC(=O)Nc1cccc(C(=O)N/N=c2/sc3ccccc3n2C)c1 103489769 JKABUEBXJZGTBU-DYTRJAOYSA-N 354.435 2.834 50 40 FFGB O=C(C[C@H]1C[C@@H]2CC[C@@H]1C2)NNC(=O)c1cncn1-c1ccc(F)cc1 103014984 MNPYEKOXSVGOQB-MGPQQGTHSA-N 356.401 2.599 50 40 FFGB Cc1cc([N+](=O)[O-])cc(/C=N/NC(=O)c2cc(-c3ccccc3)n[nH]2)c1O 36148105 KCOWEIPMLXETIT-VXLYETTFSA-N 365.349 2.763 50 40 FFGB N#C/C(=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(=O)NC(N)=O 409224694 IRAFYCWERBZCLS-YVMONPNESA-N 360.713 2.610 50 40 FFGB CCc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(N)=O)cc1 13786682 LBPFCLVXHQFGEO-RVDMUPIBSA-N 374.400 2.750 50 40 FFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1ccc(N2CCCCC2)o1 4526142 VYSSCZYMOVXCDO-UDWIEESQSA-N 355.394 2.691 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc(NC(=O)C3CC3)cc2)ccc1O 4616482 TYYHTFJIMFZZAD-CIAFOILYSA-N 367.405 2.903 50 40 FFGB Cc1ccccc1NC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br 408691284 ZFNUKQJPJNMCBQ-JOJVEKOVSA-N 350.212 2.505 50 40 FFGB O=C(CSc1ccccc1F)NNS(=O)(=O)c1ccc(Cl)cc1 7386885 KOSWYHGLTQGZFM-UHFFFAOYSA-N 374.846 2.581 50 40 FFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1ccc2c(c1)OCCO2 408591277 SODDMPIAGKBBRN-YBFXNURJSA-N 371.349 2.529 50 40 FFGB O=C(O)c1ccc(/C=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 31670117 VHPIDRVIYQWGDV-HAHDFKILSA-N 374.396 2.771 50 40 FFGB NC(=O)[C@H](Br)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 222022840 KARJLQXIQFBVED-HAPPLVQASA-N 351.082 2.969 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2OC)cc1 45363310 ZEWOSOBSEOEBHI-MHWRWJLKSA-N 352.390 2.936 50 40 FFGB O=C(CCCC(=O)NN=Cc1ccc(F)cc1)NN=Cc1ccc(F)cc1 254753979 XGLMBDGHMWBHMF-UHFFFAOYSA-N 372.375 2.736 50 40 FFGB COc1cc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cc(Cl)c1O 5175850 DQPLGQRCKWMZRP-DJKKODMXSA-N 361.785 2.777 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1Br 6182153 DZRMZNPFWPPDSE-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB N#C/C(=C/N1CCN(c2ccccc2)CC1)C(=O)Nc1ccc(F)cc1 32021058 UBYKLIZFNZOZQF-NXVVXOECSA-N 350.397 2.994 50 40 FFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)[C@@H](OC)c1ccccc1 100285454 TZGGRRJZFANTNJ-KWJZBXMYSA-N 369.421 2.904 50 40 FFGB CCC(=O)c1ccc(OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 5579074 CSWLTFNOFHKSNM-UHFFFAOYSA-N 360.797 2.773 50 40 FFGB COc1cc(OC)cc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c1 408712707 JVBJGHGNTHTTNB-UHFFFAOYSA-N 370.796 2.789 50 40 FFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)C)c32)cc(OC)c1OC 5633480 AQXRGZIUDXGFHP-AWEZNQCLSA-N 370.409 2.777 50 40 FFGB C[C@@H](SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1)C(=O)Nc1ccccc1 7252414 GXFTUMNLZBYUMN-YPMHNXCESA-N 354.435 2.778 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2cccnc2N2CCCCC2)cc1 40143859 ATLZYPNXNJIGAI-UHFFFAOYSA-N 368.437 2.545 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)c(O)c1 6026365 WOVLLYUPYFQWRW-FYJGNVAPSA-N 368.437 2.961 50 40 FFGB C/C(CC(=O)NCCc1ccccc1)=N\NC(=O)COc1ccccc1C 4416319 NWPHKDCTLFPIIH-HAVVHWLPSA-N 367.449 2.615 50 40 FFGB C[C@H](CC(=O)NNC(=O)CCc1ccccc1)CC(=O)Nc1ccccc1 4784723 BMDWDCHMZZYGKT-INIZCTEOSA-N 367.449 2.822 50 40 FFGB O=C1NC[C@@H](c2ccccc2)[C@H]1C(=O)N/N=C/c1ccc2ccccc2c1 4322467 URMMYKMQBMBWSI-OAHXUYNSSA-N 357.413 2.820 50 40 FFGB CN1C(=O)/C(=N/NC(=O)CSc2ccc(Cl)cc2)c2ccccc21 409338767 ANIKCACNGWOCOL-CAPFRKAQSA-N 359.838 2.929 50 40 FFGB CC(C)n1nnnc1SCC(=O)/C(C#N)=C1/Sc2ccccc2N1C 8780331 VFODFHJPXTVMJW-RVDMUPIBSA-N 372.479 2.892 50 40 FFGB CCCCCOC(=O)c1ccc(N/C=C(\C#N)C(=O)N2CCOCC2)cc1 4342068 RKUXAVAIZUWMDN-BMRADRMJSA-N 371.437 2.712 50 40 FFGB C/C(=N\NC(=O)CN(c1cc(Cl)ccc1C)S(C)(=O)=O)C(C)(C)C 408774812 QTFDGTGQASOURW-LDADJPATSA-N 373.906 2.953 50 40 FFGB CCOC(=O)Nc1ccc(C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1 17446035 VSKVIBJVFGEEHC-UHFFFAOYSA-N 373.434 2.880 50 40 FFGB C/C(CC(=O)Nc1ccc(Cl)c(Cl)c1)=N/NC(=O)C[N+](C)(C)C 5503124 JRDQNDZOLXGERY-GRSHGNNSSA-O 360.265 2.520 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1ccc(I)o1 5515009 RXMTZGYGXKRDFG-OVCLIPMQSA-N 370.146 2.657 50 40 FFGB CCOc1cc([N+](=O)[O-])cc(/C=C(\C#N)C(=O)NCc2ccco2)c1O 32530325 KUFFATMJXLEMAK-WUXMJOGZSA-N 357.322 2.515 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1[nH]c(C)c(C(C)=O)c1C 2639703 SXTAYRRJKUBEPC-UHFFFAOYSA-N 363.801 2.571 50 40 FFGB CCOC(=O)c1ccc(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2)cc1 59434124 CCEPJRITCCOIIJ-RGVLZGJSSA-N 373.796 2.606 50 40 FFGB CC(C)NC(=O)CC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 59515325 YEUKNMGYADUEHI-FYJGNVAPSA-N 353.422 2.630 50 40 FFGB CC1=NN(c2ccccc2)C(=O)[C@H]1/C=C(/C#N)C(=O)NCc1ccccc1 408747893 VJKOWCSQVYVDAB-GTVARFKMSA-N 358.401 2.792 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2ccc(OC)cc2O)c(OCC)c1 409391761 LDXCKWUCHOLCNF-UDWIEESQSA-N 358.394 2.962 50 40 FFGB NNC(=O)CSc1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O 9319738 FTHSPSPRIZVHAG-UHFFFAOYSA-N 359.838 2.931 50 40 FFGB C[C@@H]1CCc2sc(C(=O)NNC(=O)CC(C)(C)CC(=O)O)cc2C1 16478859 QPXMBZNETJPOEY-SNVBAGLBSA-N 352.456 2.525 50 40 FFGB C/C(=N\NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O)c1ccccc1 408784696 RWIFLYLIUYXFIT-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB CCOc1ccc(N[C@H]2SC(=O)N(CCBr)C2=O)cc1 36626558 MRZVBULIXQREBN-NSHDSACASA-N 359.245 2.914 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccco2)cc(Br)c1O 44062250 VIQUZSILJLAAQX-LZYBPNLTSA-N 353.172 2.910 50 40 FFGB N#C/C(=C/c1ccccc1)C(=O)NC[C@H](c1cccs1)N1CCOCC1 98004274 VNKNSANDDWLLNW-MTMYEVCSSA-N 367.474 2.845 50 40 FFGB [O-][n+]1c2ccccc2nn1-c1ccc(N(CCCl)CCCl)cc1 1558041 JMOBVNHEHGTZOB-UHFFFAOYSA-N 351.237 2.943 50 40 FFGB C/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1C)c1ccc2c(c1)OCCO2 408877242 TVOKIPWCGSRRSQ-XDHOZWIPSA-N 355.350 2.828 50 40 FFGB CCOc1ccc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)c(OCC)c1 409160695 IBOWJDSGUXUSMG-CIAFOILYSA-N 370.405 2.906 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@H]2Cc3cc(Cl)ccc3O2)c2ccccc21 15823812 BGEFFUXKUCLHIJ-QGZVFWFLSA-N 369.808 2.596 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)CCCOc2ccc(C)cc2)cc1 7640025 IVGHEIGYRFGOCV-UHFFFAOYSA-N 370.449 2.943 50 40 FFGB O=C(C[C@H](C(=O)O)c1ccccc1)NNC(=O)C12CC3CC(CC(C3)C1)C2 16481009 HZRRJFGMIJRMDY-WRQGHLQJSA-N 370.449 2.609 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@H]2C[C@@H]2c2ccccc2F)c2ccccc21 70019300 JKDYOPWTHRBKTK-CABCVRRESA-N 351.381 2.882 50 40 FFGB Cc1ccc(C)c(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)c1 20208274 XQJXFZFHTOZSGC-UHFFFAOYSA-N 365.499 2.896 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(C)s3)CC2=O)cc1 409263261 BKMQPHWMYDHDFN-GJUHEBOISA-N 357.435 2.568 50 40 FFGB O=C1NC2(CCCCC2)C(=O)N1CCCCN(CCCl)CCCl 5566777 PXENQTLTPNNJAD-UHFFFAOYSA-N 364.317 2.801 50 40 FFGB COc1cccc(C(=O)NNC(=O)c2cnc3c(Cl)cccc3c2N)c1 20728556 PFRYTJWWJUHFRK-UHFFFAOYSA-N 370.796 2.554 50 40 FFGB Cc1cc([N+](=O)[O-])nn1CC(=O)N/N=C/c1c(Cl)cccc1Cl 676217 KKTWVYNOCJUUPH-OMCISZLKSA-N 356.169 2.557 50 40 FFGB COC(=O)C1=C(CBr)N(C2CC2)C(=O)N[C@@H]1c1ccccc1 10223721 JBKGWKWOZKGXQM-CQSZACIVSA-N 365.227 2.737 50 40 FFGB Cc1ccc(-n2ncc3c(NNC(=O)Cc4ccccc4)ncnc32)cc1 2340630 UJVCJJKYPZVJCV-UHFFFAOYSA-N 358.405 2.810 50 40 FFGB O=C(NNC(=O)C1CC1)c1ccc(Cl)c(NC(=O)c2cccs2)c1 12794756 MMHPFRPKYCKLAH-UHFFFAOYSA-N 363.826 2.825 50 40 FFGB CC(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(OC(C)C)cc2)c1 9455757 KUXYBCDYQIVURB-UHFFFAOYSA-N 355.394 2.507 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc([N+](=O)[O-])cc2)c(OC)c1 408872607 HDSHQROLGREYNG-OQLLNIDSSA-N 367.361 2.835 50 40 FFGB CC(=O)Nc1sc(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])c(C)c1C#N 408721683 KZVJOCRLKSPEHV-QGMBQPNBSA-N 371.378 2.559 50 40 FFGB Cc1ccc(S(=O)(=O)N2CCC3(CC2)C[C@@H](Br)CO3)cc1 11114134 PZKRTYUDJDEFRO-CYBMUJFWSA-N 374.300 2.702 50 40 FFGB C[C@@H](Oc1cccc2cccnc12)C(=O)N/N=C/c1ccc2c(c1)OCO2 716822 TWIOQZWYENBSIJ-XIJPWPHISA-N 363.373 2.881 50 40 FFGB COC(=O)c1cccc(I)c1CBr 39160448 CUEGDTXCXXXFCA-UHFFFAOYSA-N 354.969 2.973 50 40 FFGB CC/C(=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 4695805 KHTZDZOGNKNHMQ-SDXDJHTJSA-N 356.338 2.976 50 40 FFGB N#C/C(=C/c1cn(CC(=O)O)c2ccccc12)C(=O)Nc1ccc(O)cc1 6045786 KEMWGVGIWDBGTR-LCYFTJDESA-N 361.357 2.977 50 40 FFGB O=C(N/N=C/c1cc(I)ccc1O)c1ccccc1 19691829 CBZPHUGJORFSAD-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB C/C(CC(=O)Nc1ccc(Cl)cn1)=N\NC(=O)Cc1cccs1 100548335 RQTXGPPNGUGMOM-VXLYETTFSA-N 350.831 2.860 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CSc3ccccc3)ccc21 2663666 FRDVEDQCDCBSTJ-UHFFFAOYSA-N 368.462 2.918 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1OC 107939048 WSWGGTFZUPBGCT-YBFXNURJSA-N 373.365 2.775 50 40 FFGB COc1ccc(Cl)cc1C(=O)N/N=C/c1ccc(N2CCOCC2)cc1 3334795 MSJXYPQBMKXELD-FYJGNVAPSA-N 373.840 2.949 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(F)cc2)c1 4549288 CIDTWFOBJOEDGX-WSDLNYQXSA-N 373.384 2.977 50 40 FFGB CN(C)c1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)o1 408997142 RQULLSOBUPROLB-RQZCQDPDSA-N 362.411 2.637 50 40 FFGB CCOc1c(Br)cc(/C=C(/C#N)C(=O)N(C)C)cc1OC 59333513 AGSVGRSXHRWZEP-WDZFZDKYSA-N 353.216 2.852 50 40 FFGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccccc2[N+](=O)[O-])cc1 59515521 COOOBMHZQCMBHT-YBFXNURJSA-N 354.366 2.807 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2ccc(NC(C)=O)cc2)cc1OC 4502771 JEIKBRYORDJFMN-CIAFOILYSA-N 355.394 2.816 50 40 FFGB C/C(=N/NC(=O)c1ccncc1)c1cccc(NC(=O)C(F)(F)F)c1 5381349 PONRMKKJFYMHEM-YVNNLAQVSA-N 350.300 2.736 50 40 FFGB N#CC1=C(N)Oc2oc3ccccc3c(=O)c2[C@@H]1c1ccc([N+](=O)[O-])cc1 1073559 YBDNLXDMMWOWFH-OAHLLOKOSA-N 361.313 2.919 50 40 FFGB O=C(NNC(=O)c1ccc(N2CCCC2=O)cc1)c1ccc(Cl)cc1 3395808 CVWGQUFXZQLDRB-UHFFFAOYSA-N 357.797 2.542 50 40 FFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)cc1 408609633 KTKLCLDLUKEWTP-YDZHTSKRSA-N 371.412 2.771 50 40 FFGB CCCCc1n[nH]c2c1[C@]1(C(=O)Nc3ccc(Cl)cc31)C(C#N)=C(N)O2 8568093 ZHNXHSJJBHISNZ-GOSISDBHSA-N 369.812 2.730 50 40 FFGB CCOC(=O)Cn1c(C)c(/C=N\NC(=O)c2ccncc2)c2ccccc21 408920720 KUODOVGSHOAPGH-UUYOSTAYSA-N 364.405 2.672 50 40 FFGB NNC(=O)c1ccc([C@@H]2c3sc(=O)[nH]c3S[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)cc1 245241594 KJTWZWQRLVXAGM-HTVCTNPSSA-N 373.503 2.692 50 40 FFGB Cc1nn(-c2ccccc2)c(O)c1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 6269023 YGPDCAZCGQJMKW-YBFXNURJSA-N 365.349 2.558 50 40 FFGB Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1cccc(C(=O)O)c1 6787146 MGTLQQPQCQBQMK-WSDLNYQXSA-N 362.389 2.951 50 40 FFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc(OC)c1OC 716753 TWSVURCWPHWPRC-KRWDZBQOSA-N 354.362 2.636 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccco2)cc1I 953767 CCZMFTWBTLFHAI-OVCLIPMQSA-N 370.146 2.657 50 40 FFGB CC(=O)NNC(=O)CSc1nc(C)c(C)n1[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 107329190 PFXSEEHHDLLQOM-QCEMKRCNSA-N 364.515 2.757 50 40 FFGB CC(C)CC(=O)Nc1ccc(C(=O)NNC(=O)/C=C/c2ccco2)cc1 4617018 MPPVUVRWPVVOIS-MDZDMXLPSA-N 355.394 2.739 50 40 FFGB C[C@H](SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1)C(=O)Nc1ccccc1F 7581741 ICPACHAKFFHWHW-WDEREUQCSA-N 372.425 2.917 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cccn1-c1ccc(O)cc1 34793126 ZXBKXUMYWSXUTH-MOSHPQCFSA-N 364.361 2.784 50 40 FFGB COc1cccc(C(=O)NNC(=O)COc2ccc3ccccc3c2)c1 829239 SFYYJRBZDMLCJP-UHFFFAOYSA-N 350.374 2.688 50 40 FFGB CCc1cc2ccccc2nc1SCC(=O)NNC(=O)c1ccco1 4849230 OVZWHDUEFUFALB-UHFFFAOYSA-N 355.419 2.944 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1 942011 WNTHNHKOFQASAZ-FMIVXFBMSA-N 367.430 2.890 50 40 FFGB CC(=O)Nc1ccc(NC(=O)C/C(C)=N\NC(=O)c2ccc(F)cc2)cc1 4199168 IUUWXOYMHBESIV-FMCGGJTJSA-N 370.384 2.919 50 40 FFGB CSc1ncc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)cc2)n1 13629137 QLCHBYGEMXEZJI-UHFFFAOYSA-N 357.222 2.580 50 40 FFGB C/C(=N\NC(=O)c1cccc(Br)c1)c1c(O)cc(C)oc1=O 5441338 YRMFBGLDNKRUMN-RQZCQDPDSA-N 365.183 2.570 50 40 FFGB COC(=O)c1ccc(N/C=C(/C#N)S(=O)(=O)c2ccc(OC)cc2)cc1 100676523 XOMBOISORJRTEC-ATVHPVEESA-N 372.402 2.733 50 40 FFGB O=C(N/N=C/c1cc2cc3c(cc2nc1Cl)OCO3)c1cccnc1 32608395 QWNPJICANYAZQV-DNTJNYDQSA-N 354.753 2.776 50 40 FFGB C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)/C(C#N)=C/c2ccc(N(C)C)cc2)C1 6534491 PLAIMSXANCZSMY-DYLQZCCESA-N 369.465 2.707 50 40 FFGB CCc1cccc(CC)c1NC(=O)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 7783625 ALRHBEOMNDUEMQ-UDWIEESQSA-N 368.393 2.808 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2c(Cl)nc3sccn23)cc1 3196600 FLIWMDQWUNUMQQ-CAOOACKPSA-N 364.814 2.587 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/C=C/c1ccccc1[N+](=O)[O-] 4616830 DOSKFPSATFBOGJ-FJIBGIISSA-N 370.321 2.697 50 40 FFGB COCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(F)c(Cl)c2)C1=O 9051943 QYGJPDQXKGSWCE-LCYFTJDESA-N 363.776 2.630 50 40 FFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1cc2cc([N+](=O)[O-])ccc2o1 408963603 CQGGKIYXPPSJQE-CAOOACKPSA-N 370.277 2.719 50 40 FFGB O=C(O)[C@H](Br)[C@H](Br)c1cccc([N+](=O)[O-])c1 6220975 AYUJMWVMPDGXFF-HTQZYQBOSA-N 352.966 2.879 50 40 FFGB COc1ccccc1/C=N\NC(=O)[C@H](NC(=O)Cc1cccs1)C(C)C 17150259 ZSCWRUPPVWQKHT-BDBXIWDTSA-N 373.478 2.590 50 40 FFGB COc1cc(Br)c(/C=N/NC(=O)Cc2cccs2)cc1O 7813886 YRNOKUJTMPVQPO-LZYBPNLTSA-N 369.240 2.918 50 40 FFGB CCOC(=O)COc1ccc(/C=N\NC(=O)Cc2ccc(CC)cc2)cc1 409365670 VQKBXIVBHAZRGK-HMAPJEAMSA-N 368.433 2.884 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(I)o2)cc1 3156446 PSHKEMJIIIPKBM-OVCLIPMQSA-N 370.146 2.657 50 40 FFGB CC1=C(C(=O)C(C)C)[C@@]2(C(=O)Nc3ccc(Cl)cc32)C(C#N)=C(N)O1 1057600 MCFURTBMEYFMGW-SFHVURJKSA-N 357.797 2.753 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2cc(-c3ccccn3)nc3ccccc23)on1 12543945 MTZWLDNBJWLKMQ-UHFFFAOYSA-N 373.372 2.668 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C 58913945 HIWQNZWKDQLWST-UUYOSTAYSA-N 372.856 2.890 50 40 FFGB CCN(Cc1ccc2c(c1)OCO2)C(=O)NNC(=O)c1ccc(C)s1 63200880 MQRDURCWOYWGSB-UHFFFAOYSA-N 361.423 2.662 50 40 FFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3)CC2)c1 409004820 DWFLUIMSFREWAK-PXLXIMEGSA-N 365.433 2.698 50 40 FFGB N[C@H](CSSC[C@H](N)C(=O)c1ccccc1)C(=O)c1ccccc1 17128560 ZDBVPJBBFXZIQV-IYBDPMFKSA-N 360.504 2.788 50 40 FFGB CN(CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12)c1ccccc1 32795487 URJGDPNEDRLQAI-UHFFFAOYSA-N 365.437 2.638 50 40 FFGB CC(C)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(O)c3)[C@@H]2C1 13471527 PBMOQROQJMANGG-RTBURBONSA-N 359.433 2.526 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2cccc(OC3CSC3)c2)cc1 408863424 MRMZMQYIONSHDA-KEBDBYFISA-N 372.446 2.719 50 40 FFGB COc1ccc2c(c1)c(C(=O)NN=Cc1ccc(O)c(O)c1)c(C)n2C 252678639 GRSYYSJWKKXZNH-UHFFFAOYSA-N 353.378 2.670 50 40 FFGB CC(=O)OC(=O)c1ccc(CN2C(C)=NS(=O)(=O)c3ccccc32)cc1 33357777 HSILXNNRJLSGNQ-UHFFFAOYSA-N 372.402 2.517 50 40 FFGB Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1C 102612194 SSEYSTVHQULNHX-LACSLYJWSA-N 364.239 2.813 50 40 FFGB CC(C)c1ccc(OCC(=O)N/N=C\c2ccccc2OCC(=O)O)cc1 5644691 YBUOEXZSBVYZNC-NHDPSOOVSA-N 370.405 2.803 50 40 FFGB CCOC(=O)N/N=C(\C)c1ccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 13572595 OATKSAVZVHIREP-VTLGGBRFSA-N 357.410 2.836 50 40 FFGB Cc1ccc(N2C(=O)[C@H]3SC(N)=C(C#N)[C@@H](c4ccco4)[C@@H]3C2=O)cc1 19858364 GHPDSTAHLAOERL-JYJNAYRXSA-N 365.414 2.671 50 40 FFGB Cc1ccc(-c2nc3ccccc3nc2NNC(=O)CCC(=O)O)cc1 176691 CMVSJRGIIMCVKU-UHFFFAOYSA-N 350.378 2.913 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(F)cc1 4502861 RWFANUYLVBZBAC-CQSZACIVSA-N 358.398 2.774 50 40 FFGB CCc1ccc(CC(=O)N/N=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 409362543 HUEGLMSYPHFRDE-UDWIEESQSA-N 371.393 2.867 50 40 FFGB COC(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1 8353235 CKRJGFKKKAQENB-UHFFFAOYSA-N 370.449 2.841 50 40 FFGB Cc1noc(C)c1COc1cccc(C(=O)NNC(=O)c2ccoc2C)c1 13140942 KDBUHOGJBAZOFS-UHFFFAOYSA-N 369.377 2.847 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)Cc2c(F)cccc2Cl)c1 22698627 GKGIEMHDTPHRDH-UHFFFAOYSA-N 364.804 2.865 50 40 FFGB CCOC(=O)c1[nH]c(C)c([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)c1C 1069936 AAPHPQOLGDSXAQ-HNNXBMFYSA-N 355.394 2.623 50 40 FFGB CCCSc1ccc(C(=O)[C@@H](CO)NC(=O)C(Cl)Cl)cc1 2048264 VSFNICGGMBPUOL-LLVKDONJSA-N 350.267 2.652 50 40 FFGB O=C(N/N=C/c1cc(O)ccc1[N+](=O)[O-])c1cccc(Br)c1 36245302 AUODSCSPWSIGCB-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)CCCOc2ccc(C)cc2)c1 6454379 WXQFZJRCDHSRRH-UHFFFAOYSA-N 372.421 2.632 50 40 FFGB CC[C@H](C)NC(=O)/C(C#N)=C/c1cc(Br)cc(OC)c1O 408812236 OAJFNXYFBPJWIZ-WUFUFFIZSA-N 353.216 2.985 50 40 FFGB COc1ccccc1N1C[C@H](C(=O)Oc2ccc([N+](=O)[O-])cc2)CC1=O 408657675 IURRXWVELBNVQI-GFCCVEGCSA-N 356.334 2.562 50 40 FFGB CCOc1cc(Br)cc(/C=N/NC(=O)c2cccnc2)c1O 793808 SHDJIAXQWCTJHH-GIJQJNRQSA-N 364.199 2.712 50 40 FFGB COc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1[N+](=O)[O-] 7384653 KKBRBODBIBUEQR-DEDYPNTBSA-N 368.393 2.968 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)[C@H]2COc3ccccc3O2)c(O)c1 13583797 JXNQIWOHLPGYPI-GFIJVFARSA-N 369.421 2.529 50 40 FFGB Cc1ccc(-n2cnc3c(N(CCCl)CCCl)ncnc32)cc1N 1657380 HSLCSNFRYAWSPZ-UHFFFAOYSA-N 365.268 2.990 50 40 FFGB CC(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 58884956 SRLOXYIDNCYHOM-YBFXNURJSA-N 354.366 2.807 50 40 FFGB CCc1sc(C(=O)NNS(=O)(=O)c2cc(C)ccc2C)cc1C 7387159 NKZJPTGBDSQJLC-UHFFFAOYSA-N 352.481 2.859 50 40 FFGB CCOc1ccc([C@H]2C(C(=O)OC)=C(C)N=C3SC(C#N)=C(N)N32)cc1 408608480 WOTVPOBSTRFQPO-HNNXBMFYSA-N 370.434 2.643 50 40 FFGB CNC(=O)/C(C#N)=C/c1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] 8091860 RBUIOIWQSFXHOT-OVCLIPMQSA-N 367.361 2.835 50 40 FFGB CC/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(OC)c(OC)c1 6377812 YJOVZDSYULSULW-ORTNRGLGSA-N 370.405 2.774 50 40 FFGB O=C(NNC(=O)c1cncn1-c1ccccc1)c1cc2cc(F)ccc2[nH]1 40058810 SEPLDZSXZNLJGN-UHFFFAOYSA-N 363.352 2.568 50 40 FFGB C/C(=N\NC(=O)c1cccnc1)c1ccc(NC(=O)c2cc(C)on2)cc1 6796886 MRCRPFCZMDVWMB-LPYMAVHISA-N 363.377 2.784 50 40 FFGB C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1 4115156 SLCAPPSOGCMOQX-YDZGXFTCSA-N 355.401 2.633 50 40 FFGB CC[C@H](Oc1ccc(C)cc1)C(=O)NNC(=O)Cc1ccc(OC)cc1 12137422 SXPWJYPYAZSXBL-SFHVURJKSA-N 356.422 2.551 50 40 FFGB O=C(NCCc1ccccc1)C(=O)N/N=C/c1cccc(Cl)c1Cl 59506593 NUWIWUWACCSTAJ-SRZZPIQSSA-N 364.232 2.802 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 59515665 JUQOOQNIAKEFTQ-KGENOOAVSA-N 353.422 2.584 50 40 FFGB Cc1cc(C(=O)N/N=C/c2ccc(O)c(O)c2O)c(C)n1-c1ccccc1 3234975 PAOMXTMEGYGJOW-SRZZPIQSSA-N 365.389 2.975 50 40 FFGB Cc1cccc(C(=O)NCC(=O)N/N=C/c2cccc(OC(C)C)c2)c1 4544254 YDEHLINQYFLLRR-WSDLNYQXSA-N 353.422 2.662 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cccc(OC)c2O)cc1 223173598 GRBITZRGWBMTTL-UVTDQMKNSA-N 352.346 2.733 50 40 FFGB C/C(=N\NC(=O)COc1ccc2ccccc2c1)c1c(O)cc(C)oc1=O 6418414 XEFSKDJPDCRWSH-FYJGNVAPSA-N 366.373 2.726 50 40 FFGB CCOC(=O)[C@@H](C)/C(C)=N/NC(=O)CCC(=O)Nc1cc(C)ccc1C 4523951 MQIGXIUEQKDHKG-OOJJEUIESA-N 361.442 2.713 50 40 FFGB N#C/C(=C/c1ccc(C#N)cc1)C(=O)Nc1ccc(N2CCOCC2)cc1 6923099 YZAIVXWETISIQI-AQTBWJFISA-N 358.401 2.941 50 40 FFGB CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc3c(c2)OCCO3)C1=O 9422099 UFCKBBHAGFXUSP-IEMQHYRPSA-N 367.405 2.761 50 40 FFGB COc1ccccc1N1C[C@@H](C(=O)Oc2ccc([N+](=O)[O-])cc2)CC1=O 408657679 IURRXWVELBNVQI-LBPRGKRZSA-N 356.334 2.562 50 40 FFGB C/C(=N\NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O)c1ccc(C)cc1 408921360 GWBPASJBLGUANV-MURKYSCBSA-N 373.478 2.690 50 40 FFGB C[C@@H](SCc1ccccc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 40140074 WDSJHIWFRZQKBP-GFCCVEGCSA-N 359.407 2.678 50 40 FFGB COc1ccc(/C=N/NC(=O)CN2Cc3cc(C)c(C)cc3C2)cc1OC 409206301 UBJOAIGLEZFHRH-LSHDLFTRSA-N 367.449 2.787 50 40 FFGB CC(C)=NNC(=O)c1ccc(N(Cc2ccccc2)S(C)(=O)=O)cc1 20059294 NOLWHNYTQMHDJJ-UHFFFAOYSA-N 359.451 2.778 50 40 FFGB N#CC1=C(N)Oc2c(oc(CO)cc2=O)[C@H]1c1c(Cl)cccc1Cl 664089 XCNYOTDRZOZTQK-GFCCVEGCSA-N 365.172 2.657 50 40 FFGB CN(C)/N=C/c1ccc(P(=O)(c2ccccc2)c2ccccc2)n1C 103446094 ZZZAAPBWJYYAPW-LTGZKZEYSA-N 351.390 2.560 50 40 FFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)C12CC3CC(CC(C3)C1)C2 4473198 KYZORKVQAOTUGZ-AWQFTUOYSA-N 371.393 2.990 50 40 FFGB O=C(NCCCN1CCOCC1)[C@H]1Cc2ccccc2[C@H]1C(Cl)Cl 95677005 HCDPYHLDBBGAFP-JKSUJKDBSA-N 371.308 2.585 50 40 FFGB O=C(COc1ccc(F)cc1Cl)NNC(=O)c1ccc(Cl)cc1 11028211 XLSSMOVOGMWJOM-UHFFFAOYSA-N 357.168 2.973 50 40 FFGB COc1ccc(O)c(/C=N\NC(=O)c2cc(Br)ccc2O)c1 19799738 PNJVVMXXUDHACX-IUXPMGMMSA-N 365.183 2.633 50 40 FFGB O=C(CCCC[C@@H]1CCSS1)N[C@H]1CCc2nnc(O)cc2C1 575610016 NNGHDYRYCZUFIQ-QWHCGFSZSA-N 353.513 2.870 50 40 FFGB C[C@@]1(CCCc2ccc(N(CCCl)CCCl)cc2)NC(=O)NC1=O 2033371 NXEBFKUVSHFAOQ-KRWDZBQOSA-N 372.296 2.891 50 40 FFGB CCc1c(C(=O)NNC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)O)csc1C 2765294 ZQPZNPVQFAMIRN-UONOGXRCSA-N 364.467 2.827 50 40 FFGB Cc1ccccc1NC(=S)NNC(=O)c1nnn(-c2ccccc2)c1C 632370 NTMUQFYIONANPG-UHFFFAOYSA-N 366.450 2.516 50 40 FFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc1 409388135 UKKGMZJYVSJJND-BOPFTXTBSA-N 367.405 2.724 50 40 FFGB C/C(=N\NC(=O)Cc1nc2sc(C)c(C)c2c(=O)[nH]1)c1cccc(F)c1 20934069 DJBCOAZRXARHBX-LSHDLFTRSA-N 372.425 2.823 50 40 FFGB CN1C(=O)/C(=C(\C#N)C(=O)NCc2ccc(Cl)cc2)c2ccccc21 3265645 SDWKCTJENVFUOS-BMRADRMJSA-N 351.793 2.910 50 40 FFGB CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2cccc(O)c2)cc1 4525198 ABQQKPSFXFVSNN-DEDYPNTBSA-N 355.394 2.660 50 40 FFGB CC(C)NC(=O)/C(C#N)=C\c1cc(Cl)c(OCC(=O)O)c(Cl)c1 408778131 BNBSAILOUOWBPW-KMKOMSMNSA-N 357.193 2.888 50 40 FFGB CCOc1cc(/C=C(\C#N)C(N)=S)cc(I)c1O 408542163 HGVJVLSPFWERQJ-FPYGCLRLSA-N 374.203 2.589 50 40 FFGB O=C(Cc1csc(-c2ccccc2Cl)n1)NNC(=O)c1ccncc1 12889632 PFGOPSXCEFLKQB-UHFFFAOYSA-N 372.837 2.862 50 40 FFGB O=C(N/N=C/c1cc(Cl)ccc1O)c1cncc(Br)c1 1440653 RCZKTDXRBWTJTN-UBKPWBPPSA-N 354.591 2.967 50 40 FFGB CC(=O)O[C@]12[C@@H]3[C@@H]4[C@H]5C[C@@H]3[C@H]([C@H]5[C@H]1[C@H]4Br)[C@@H]2Br 100500317 OWYYCXRWCMJAHL-GTJZZSSWSA-N 362.061 2.587 50 40 FFGB CCOc1ccccc1N1C[C@H](C(=O)NN(C)c2ccccc2)CC1=O 58356234 DAJHMQOPPKCSEA-OAHLLOKOSA-N 353.422 2.606 50 40 FFGB N#CC1=C(N)N2C(=C(C#N)[C@@H]1c1ccc3c(c1)OCO3)Nc1ccccc12 2252049 RPOAHSBEEMGVTD-GOSISDBHSA-N 355.357 2.874 50 40 FFGB O=C(N/N=C/c1ccccc1C(=O)O)c1cc(Br)ccc1O 59167168 SHRDYAORQWLMLW-CAOOACKPSA-N 363.167 2.617 50 40 FFGB CC(C)Oc1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)c(F)c1 97164694 JRERQNHYRFPXAU-UHFFFAOYSA-N 354.773 2.787 50 40 FFGB C/C=C/c1ccc(OCC(=O)NNC(=O)c2ccc(F)cc2)c(OC)c1 6627889 MSXJGIZMEBDJPE-ONEGZZNKSA-N 358.369 2.707 50 40 FFGB COc1cc(N2CCOCC2)ccc1/C=N\NC(=O)Nc1ccccc1 409233696 WCQJUQDXEZINHH-ZHZULCJRSA-N 354.410 2.687 50 40 FFGB O=C(COc1cc(Cl)ccc1Cl)N/N=C/c1ccc(O)cc1O 805627 KSNOSXRGQPVNSO-CNHKJKLMSA-N 355.177 2.934 50 40 FFGB Cc1ccc2c(c1)/C(=N/NC(=O)COc1c(C)ccc(C)c1C)C(=O)N2 13476892 BITHZGRNWHSXTB-UHFFFAOYSA-N 351.406 2.772 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccncc2)cc(Br)c1OC 5357270 RZMORHWOWZCWPS-GIJQJNRQSA-N 364.199 2.625 50 40 FFGB O=C(CCCl)Nc1cc(S(=O)(=O)N2CCCC2)ccc1Cl 32626775 VFMXOAWGDZGRPW-UHFFFAOYSA-N 351.255 2.692 50 40 FFGB in-vitro O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CC(c2ccccc2)=NO1 46900766 GLPCNIBNXVHFCG-TYUXRXASSA-N 367.449 2.543 50 40 FFGB COc1ccc(OC)c([C@@H]2NC(=O)NC(C)=C2C(=O)OCCCCl)c1 4064589 AWYCAOMTKLOVJI-HNNXBMFYSA-N 368.817 2.504 50 40 FFGB COC(=O)/C(C#N)=C/c1c(Oc2ccccc2C)nc2ccccn2c1=O 4205532 PDBUSGFCGAHMIC-SDNWHVSQSA-N 361.357 2.875 50 40 FFGB N#C/C(=C/c1cc(O)ccc1[N+](=O)[O-])C(=O)NCCCc1ccccc1 409238472 DLLNARIIBJRJSL-WJDWOHSUSA-N 351.362 2.956 50 40 FFGB O=C(O)COc1c(Cl)cc(/C=N/NC(=O)c2ccncc2)cc1Cl 4740723 XJPJAUCLJDJYMB-FBCYGCLPSA-N 368.176 2.616 50 40 FFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccccc2N)c1 408589320 LJCBKAUAMLYUHP-QGMBQPNBSA-N 364.199 2.509 50 40 FFGB O=C(Cc1nc2ccccc2[nH]1)NNC(=S)Nc1ccc(Cl)cc1 13212434 MPPPLETWPFPYLL-UHFFFAOYSA-N 359.842 2.777 50 40 FFGB CC1(C)[C@]2(C)CC[C@@]1(C(=O)NCC(F)(F)F)[C@H](Br)C2=O 7011067 XPYVXBMOLCPOGB-HFKOZYHYSA-N 356.182 2.824 50 40 FFGB CCOC(=O)c1c(NC(C)=O)sc2c1C(=O)[C@H](Br)CC2 704890 JYOZIRSGNYACQD-SSDOTTSWSA-N 360.229 2.776 50 40 FFGB NNC(=O)c1ccc([C@H]2c3sc(=O)[nH]c3S[C@H]3[C@@H]4CC[C@H](C4)[C@H]23)cc1 100972079 KJTWZWQRLVXAGM-KSTCHIGDSA-N 373.503 2.692 50 40 FFGB NC(=O)N/N=C/c1c(O)c(Br)cc2oc3c(c12)CCCC3 4898280 OEDQZRPEWSNOFI-UBKPWBPPSA-N 352.188 2.782 50 40 FFGB CN(CCO)c1ccc(/C=N/NC(=O)c2cc3c(s2)CCCC3)cc1 6831448 GGEXLIKMMYABHW-DEDYPNTBSA-N 357.479 2.819 50 40 FFGB O=C(NNc1cccc(C(F)(F)F)c1)[C@H]1CC(=O)N(Cc2ccco2)C1 68774108 SRWHDDFPGWOKGI-NSHDSACASA-N 367.327 2.790 50 40 FFGB Cn1c(=O)n(C)c2cc(/C=N/NC(=O)c3ccc4ccccc4c3)ccc21 408884811 YIJCANGEZQTLDM-LPYMAVHISA-N 358.401 2.794 50 40 FFGB COc1cc(/C=N\NC(=O)COc2cc(C)ccc2C)cc(OC)c1O 30721735 VEVKDEYBLRSAPP-JMIUGGIZSA-N 358.394 2.555 50 40 FFGB Cn1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(C(F)(F)F)n1 253402926 OZLWAEOBHCBCSS-LBPRGKRZSA-N 366.343 2.890 50 40 FFGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccc(O)cc3O)cc2)n1 1002251 RFPDYUGBFWMTDR-SRZZPIQSSA-N 364.405 2.723 50 40 FFGB O=C(CCc1nc(-c2ccccc2)no1)NNc1ccccc1[N+](=O)[O-] 32747745 ADKJESCXQPWFFU-UHFFFAOYSA-N 353.338 2.721 50 40 FFGB N#C/C(=C/c1c(Cl)cccc1Cl)C(=O)NCCCN1CCOCC1 27026281 QLXYNHAAEBJNCL-QBFSEMIESA-N 368.264 2.739 50 40 FFGB Cc1cccc(OCCCC(=O)NNC(=O)c2cccc(N(C)C)c2)c1 3429037 UBTCEJDRBWBLBO-UHFFFAOYSA-N 355.438 2.681 50 40 FFGB COC(=O)N/N=C/c1ccc(OCc2ccccc2[N+](=O)[O-])c(OC)c1 4525983 CSVHGEBKLOJMAO-VCHYOVAHSA-N 359.338 2.872 50 40 FFGB Cc1ccc(N2C(=O)[C@H]3SC(N)=C(C#N)[C@@H](c4ccco4)[C@H]3C2=O)cc1 100165556 GHPDSTAHLAOERL-XHSDSOJGSA-N 365.414 2.671 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NCC(C)C)c(C)n1-c1cccc(Cl)c1 58911368 FNXSHNXVHYVSGL-SSDVNMTOSA-N 374.872 2.970 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1Cl 59506577 QPNXEEUSHDMEGW-WSDLNYQXSA-N 371.824 2.671 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(C)c(OC)c1 408608472 WMPIFFRSEPHEQH-OAHLLOKOSA-N 370.434 2.562 50 40 FFGB COc1cc2c(cc1[C@H]1C(C#N)=C(N)OC3=C1C(=O)CC(C)(C)C3)OCO2 4510834 UPKPRMWZTTVUFR-KRWDZBQOSA-N 368.389 2.875 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)CCOc2ccc(C)cc2)cc1 7640166 SGMWNVINSLFBIT-UHFFFAOYSA-N 356.422 2.553 50 40 FFGB CCCCC(=O)N/N=C(\C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] 4405490 AUYUGNVVIHSINC-WOJGMQOQSA-N 350.375 2.614 50 40 FFGB O=C(NCc1ccco1)C(=O)N/N=C\c1ccc(-c2cccc(Cl)c2)o1 58914429 MTQPUGHIUIDWIK-NHDPSOOVSA-N 371.780 2.960 50 40 FFGB CCOC(=O)c1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NC)c2C)c1 408968784 ZCDQCBZFUFJRFD-YVLHZVERSA-N 351.406 2.924 50 40 FFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(OC)c3)[C@H]2C1 4730312 WPUAPAGWLSTJBC-VQTJNVASSA-N 373.460 2.831 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C/c1c(C)cc(O)c(C)c1O 4724242 WTAVLVBXEDPNNL-KEBDBYFISA-N 358.394 2.642 50 40 FFGB CCOC(=O)C1=C(C)NC(N)=C(C#N)[C@H]1c1cc(OCC)ccc1OCC 4816103 PZRYOOUCJKUSTQ-GOSISDBHSA-N 371.437 2.702 50 40 FFGB Cc1cc(C(F)(F)F)nn1CC(=O)NN=C1CC(C)(C)NC(C)(C)C1 6787368 TWALUZVCTIQKMB-UHFFFAOYSA-N 359.396 2.623 50 40 FFGB CCOc1cc(/C=N/NC(=O)COc2cccc3cccnc23)ccc1O 408765667 ZGMBZRALYGPYAU-WSDLNYQXSA-N 365.389 2.868 50 40 FFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(F)cc3)CC2=O)cc1 33336414 OUIKQSWAVQBGJY-YSUUHWHMSA-N 353.397 2.891 50 40 FFGB O=C(Cc1ccc(F)cc1)N/N=C\c1cc(Cl)cc([N+](=O)[O-])c1O 138581686 FQOYEPUVDRAVSH-LSCVHKIXSA-N 351.721 2.786 50 40 FFGB Cc1cccc(C(=O)N/N=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 83327494 RRLONSCQJBXRDY-MOSHPQCFSA-N 368.393 2.504 50 40 FFGB COc1ccc(/C=N/NC(=O)Nc2cccc3nsnc23)cc1OC 822458 ZTSACJMBBKLKFK-RQZCQDPDSA-N 357.395 2.864 50 40 FFGB CCOC(=O)CCn1cc(/C=C(/C#N)C(=O)OCC)c(-c2ccccc2)n1 33405211 QUKRGPMJIKLSCA-VBKFSLOCSA-N 367.405 2.973 50 40 FFGB Cc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(Br)cc1 7782217 MDZZROCGFQUFIR-VCHYOVAHSA-N 360.211 2.846 50 40 FFGB CC1(C)[C@@]2(C)CC[C@@]1(C(=O)NCC(F)(F)F)[C@H](Br)C2=O 100748366 XPYVXBMOLCPOGB-MKCWBWRRSA-N 356.182 2.824 50 40 FFGB O=C(CCl)N1CCc2c([nH]c3ccccc23)[C@]12C(=O)Nc1ccccc12 20636506 BUAQTPBSVAXOSV-HXUWFJFHSA-N 365.820 2.987 50 40 FFGB N#C/C(=C\c1ccc(OCC(N)=O)c(Cl)c1)C(=O)Nc1ccc(F)cc1 409219075 IREBRHHBZNWZSQ-KPKJPENVSA-N 373.771 2.889 50 40 FFGB O=C(Cc1cn2ccsc2n1)NNC(=O)[C@@H]1C[C@H]1c1ccccc1Cl 9337156 MDRJMFGIQHUJAE-QWHCGFSZSA-N 374.853 2.543 50 40 FFGB Cc1c(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCC3)oc2ccccc12 7380479 XAVSCQRTAUJJGP-UHFFFAOYSA-N 370.430 2.853 50 40 FFGB O=C(CN[C@H](c1ccccc1F)C1CCCC1)NNC(=O)c1ccco1 95985924 UJCJETYPEPWLJR-SFHVURJKSA-N 359.401 2.701 50 40 FFGB COc1cccc2sc(NNC(=O)c3ccc4c(c3)OCCO4)nc12 5025715 FTGMYJIZILNDLZ-UHFFFAOYSA-N 357.391 2.833 50 40 FFGB COc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1Cl 8336672 CYQZRERRWISSCC-QGMBQPNBSA-N 364.858 2.998 50 40 FFGB CC(C)(C(=O)NNC(=O)CN1CCCc2ccccc21)c1ccccc1 40049155 HGANXSJDNSZWAI-UHFFFAOYSA-N 351.450 2.564 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1c1ccc2c(c1)OCO2 808851 ICSHLBYAACDPEA-MRXNPFEDSA-N 360.325 2.740 50 40 FFGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccc(C(=O)O)cc1 110075714 DRFQEOYVZWXBQE-SSDVNMTOSA-N 373.368 2.649 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC 408864540 WVBFTABDUIGTPU-VCHYOVAHSA-N 373.321 2.513 50 40 FFGB COc1cc(/C=N\NC(=O)Cc2ccc(Br)cc2)ccc1O 37020472 XBFYXCNJQOHDNV-ZDLGFXPLSA-N 363.211 2.856 50 40 FFGB COc1ccc(CC(=O)NNC(=O)COc2ccc3ccccc3c2)cc1 829250 VPRQINYOEFXPHA-UHFFFAOYSA-N 364.401 2.617 50 40 FFGB O=C(NNC(=S)NCCc1ccccc1)C12CC3CC(CC(C3)C1)C2 4550608 ZXBQMMUMNWDFSO-UHFFFAOYSA-N 357.523 2.941 50 40 FFGB O=C(N/N=C/c1cc(Br)ccc1O)c1ccccc1[N+](=O)[O-] 997167 PBSOEGQDRCMQHK-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB N#C/C(=C\c1ccc(-c2ccc(F)cc2)o1)c1nn(CCO)c(N)c1C#N 5770072 ZSUDAEFIIOIBRP-UKTHLTGXSA-N 363.352 2.793 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2ccccc2Br)cc1 8182520 NLZYVESKAYNKLP-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)Cc2c(F)cccc2Cl)c1 2626781 XQXDGUFGWDNKGC-UHFFFAOYSA-N 366.776 2.500 50 40 FFGB Cc1nc(SCC(=O)NNC(=O)c2ccc(F)cc2)c2ccccc2n1 8075145 NPEZGZQPAWZULK-UHFFFAOYSA-N 370.409 2.631 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2cccc(F)c2)cc1OC 104813368 AXSJTVUNOUQJTM-WSDLNYQXSA-N 373.384 2.977 50 40 FFGB O=C(CCC(=O)N/N=C/[C@@H]1C[C@@H]2CC[C@@H]1C2)N/N=C/[C@H]1C[C@@H]2CC[C@@H]1C2 102248313 NXDNIKYHOJFYMV-CWZAWYNESA-N 358.486 2.843 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)NNC(=O)CCc2ccccc2)c(C)c1 2132096 RRFBYEWNFOCCSV-UHFFFAOYSA-N 367.449 2.802 50 40 FFGB C[C@H](NC(=O)NNc1cccc(C#N)c1)c1cccc(N2CCOC2=O)c1 68720376 OCCPGRSJVWEOPN-ZDUSSCGKSA-N 365.393 2.902 50 40 FFGB CCc1cc(C(=O)NNC(=O)CSC(=S)N(CC)CC)sc1C 8394518 AYIBHCSAVSRUCB-UHFFFAOYSA-N 373.569 2.740 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1ccccc1NC(=O)c1ccco1 409002060 LWNHLOSEQZXPEP-UHFFFAOYSA-N 363.373 2.536 50 40 FFGB COc1ccc(OC)c2sc(NNC(=O)COc3ccccc3)nc12 4121485 GXYTWULMRWXBRE-UHFFFAOYSA-N 359.407 2.836 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)c2sc(N)c(C#N)c2C)c(O)c1 408723699 AMKPTRXKPSUUAL-UFFVCSGVSA-N 371.466 2.826 50 40 FFGB Cc1nn(-c2ccccc2)c(Cl)c1/C=N\NC(=O)Cc1cccn1C 71335813 TZVCQAAUNUYYOZ-NDENLUEZSA-N 355.829 2.865 50 40 FFGB N#C/C(=C/Nc1ccc(S(=O)(=O)CCO)cc1)c1nc2ccccc2o1 6045875 NITXADMQWGFLMQ-SEYXRHQNSA-N 369.402 2.570 50 40 FFGB COc1ccc(C(=O)NNC(=O)c2cccs2)cc1Br 955284 GZMMLLYICDISEC-UHFFFAOYSA-N 355.213 2.594 50 40 FFGB N#CC1=C(N)N(c2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)C1(C#N)C#N 1296832 RSKVNGROIVCQOQ-QGZVFWFLSA-N 356.345 2.884 50 40 FFGB CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cccnc2)N2NC=C(C#N)C2=N1 8993596 UJDBWUFBTWLMPN-GOSISDBHSA-N 356.389 2.675 50 40 FFGB Cc1ccc(CC(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)cc1 409366247 TUACLOVGBTZAFC-YDZHTSKRSA-N 362.433 2.518 50 40 FFGB Cc1ccc(OCC(=O)N/N=C2/SC(=O)CN2c2ccc(F)cc2)cc1 928888 CWIQUGQEQPYUIY-DYTRJAOYSA-N 373.409 2.680 50 40 FFGB COc1ccc(NC(=O)CCC(=O)N/N=C/c2ccccc2OC)cc1 2746082 VCXAYLHWNXFLFE-DEDYPNTBSA-N 355.394 2.573 50 40 FFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(OC)c3)[C@H]2C1 4453467 WPUAPAGWLSTJBC-PMACEKPBSA-N 373.460 2.831 50 40 FFGB CCOC(=O)C1=C(C)NC(N)=C(C#N)[C@@H]1c1cc(OCC)ccc1OCC 4816105 PZRYOOUCJKUSTQ-SFHVURJKSA-N 371.437 2.702 50 40 FFGB COc1ccc([C@H]2CC(=O)NC(SCC(=O)NCC(C)C)=C2C#N)cc1 6306839 DXLREVWPMFAYSC-OAHLLOKOSA-N 373.478 2.539 50 40 FFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CC(c2ccccc2)=NO1 46900769 GLPCNIBNXVHFCG-YXSDIZSPSA-N 367.449 2.543 50 40 FFGB O=C(Cl)[C@@H]1CC(=O)N(CCCNc2ccc([N+](=O)[O-])cc2Cl)C1 57332508 DISWQEYDMZWULA-SECBINFHSA-N 360.197 2.664 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C/c3ccccc3Cl)CC2=O)cc1 3176529 DSNUUKPVZOWRQM-VPNURPJOSA-N 371.824 2.852 50 40 FFGB O=C(NNC(=O)c1ccc(NC(=O)C2CC2)cc1)c1ccc(Cl)cc1 6241658 NXIPPNWOMTVLNO-UHFFFAOYSA-N 357.797 2.763 50 40 FFGB O=C(Cc1ccccc1)N/N=C/c1ccccc1I 3576133 ZSFNDCGOJCLHAE-GZTJUZNOSA-N 364.186 2.984 50 40 FFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Cc1c(C)noc1C 12689404 GRRHXTJXHVRTSM-UHFFFAOYSA-N 370.434 2.727 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@H]1CC(=O)N(c2ccc(C)cc2)C1 4703039 ACMXEYFCIMHNKC-GKXUUXLPSA-N 351.406 2.507 50 40 FFGB Cc1ccc(/C=N\NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 31769306 HDRWRVXBXJNAHF-NVMNQCDNSA-N 360.757 2.645 50 40 FFGB CC(C)(C)C(=O)OC(=O)NCCCCCC(=O)NCCCCCC(=O)O 616581074 MUADQZHBJWXBLX-UHFFFAOYSA-N 372.462 2.607 50 40 FFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCCOc1ccccc1OC 4196627 BTTUQLJDWUVETA-FYJGNVAPSA-N 373.409 2.554 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1ccc(OCC(=O)OC(C)C)cc1 6563980 QRHAZLNZKPORAI-CIAFOILYSA-N 370.405 2.790 50 40 FFGB O=C(N/N=C/c1cc(Br)c(Br)o1)c1cccnc1 830874 YRYUVGIDUWIORL-GIDUJCDVSA-N 373.004 2.964 50 40 FFGB CCOC(=O)/C(C#N)=C/c1cn(CC(=O)N2CCCC2)c2ccccc12 409163109 LXDNBMGWJRJDJL-RVDMUPIBSA-N 351.406 2.734 50 40 FFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc1OC 2502497 PWSKEUUVCYKBSQ-SFHVURJKSA-N 352.346 2.651 50 40 FFGB COc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(N2CCCC2)cc1 408676627 LNOQVKWXWZKDTB-DEDYPNTBSA-N 368.393 2.968 50 40 FFGB Cc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2Br)cc1 5745186 MLCWZGCTCDZJJX-VCHYOVAHSA-N 360.211 2.846 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1 19366801 YYGRXGFVDQLEMA-HZHRSRAPSA-N 364.493 2.571 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)ccc1OCC(=O)O 59535114 IPWNRPKTVKTARI-ZROIWOOFSA-N 358.394 2.514 50 40 FFGB C#CCOc1ccc(OC)cc1/C=N\NC(=O)Cc1ccc(OCC)cc1 408711710 HBLUYBYBKWQAOU-JCMHNJIXSA-N 366.417 2.799 50 40 FFGB CCOC(=O)OC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F 575629047 PFUTWHSXZMRCPB-JTQLQIEISA-N 351.346 2.969 50 40 FFGB Cc1ccccc1C(=O)NNC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 50095730 GSMOUCSMVSCEEU-KRWDZBQOSA-N 357.385 2.562 50 40 FFGB COc1cccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c1OC 6762343 AAONUBKWUGWHFE-ZROIWOOFSA-N 352.346 2.948 50 40 FFGB CCC(=O)Nc1ccc(C(=O)NNC(=S)Nc2ccc(F)cc2)cc1 672141 SQTBFPDQJBWBGZ-UHFFFAOYSA-N 360.414 2.806 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1OCC 59472939 GKOIJGSNVQGEJK-CIPMJJFUSA-N 370.405 2.774 50 40 FFGB Cc1cc(C)cc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(N)=O)c1 2424957 RTEUUTDMIYMCDV-XNTDXEJSSA-N 374.400 2.804 50 40 FFGB CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(O)cc2)N2NC=C(C#N)C2=N1 13569500 GVEVJJMKQBCOSY-LJQANCHMSA-N 371.400 2.986 50 40 FFGB O=C(COc1ccccc1Cc1ccccc1)NNC(=O)C1CCCC1 6558356 ZFJIPYBQKFATFP-UHFFFAOYSA-N 352.434 2.994 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Cl)cc1Cl 5894693 ZASUUNFRKFBNCP-UHFFFAOYSA-N 368.176 2.905 50 40 FFGB Cc1ccc(OCC(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)cc1C 5018163 CUOBCOPFMWJJRV-UHFFFAOYSA-N 356.344 2.872 50 40 FFGB COc1cc(/C=N/NC(=O)[C@H]2[C@@H]3CCCC[C@@]32C)c([N+](=O)[O-])cc1OC 5921006 KNHUWRAENMYBRW-UOFOMLAWSA-N 361.398 2.888 50 40 FFGB C[C@](O)(CBr)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 13581050 QDSWNDMHSBZXKX-JTQLQIEISA-N 371.109 2.698 50 40 FFGB in-vivo O=C(Cl)[C@H]1CC(=O)N(CCCNc2ccc([N+](=O)[O-])cc2Cl)C1 57332510 DISWQEYDMZWULA-VIFPVBQESA-N 360.197 2.664 50 40 FFGB CCCN1C(=O)/C(=N/NC(=O)COc2cccc(C)c2C)c2ccccc21 18285853 ABAIBALFSMOJTC-BSYVCWPDSA-N 365.433 2.959 50 40 FFGB O=C(N/N=C/c1c(F)c(F)c(F)c(F)c1F)[C@@H]1COc2ccccc2O1 6684327 FBUCLDXYHYKCBL-DGMVGLJQSA-N 372.249 2.672 50 40 FFGB CC(C)CN1C(=O)/C(=N\NC(=O)CNc2ccccc2)c2ccccc21 7009215 VTUUTUHWXVHRDM-NMWGTECJSA-N 350.422 2.622 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1ccc(N2CCOCC2)cc1C 409073714 HYKYRKFUGVTBSQ-KGENOOAVSA-N 353.422 2.604 50 40 FFGB C=CCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(CC)cc2)cc1 408999280 UMFJCRKXISZXCW-KGENOOAVSA-N 351.406 2.903 50 40 FFGB CN1[C@H]2[C@@H](Br)CCCCN2c2ccc(F)cc2S1(=O)=O 13117853 OOTIIPYEXYSBQL-GXFFZTMASA-N 363.252 2.540 50 40 FFGB C/C(=N\NC(=O)c1ccc([N+](=O)[O-])cc1)C1=C(O)c2ccccc2C1=O 100852746 GAWFPUCTEVSSNW-VXLYETTFSA-N 351.318 2.866 50 40 FFGB Cc1ccc(SCC(=O)NNC(=O)CCC(=O)c2cccs2)cc1 7653062 QYZUVKUHFJUDKD-UHFFFAOYSA-N 362.476 2.959 50 40 FFGB CC(=O)O[C@@]12[C@@H](Br)[C@@H]3[C@H]4C[C@@H]5[C@H]([C@H](Br)[C@@H]1[C@@H]53)[C@@H]42 100500312 OWYYCXRWCMJAHL-MKGUQTKBSA-N 362.061 2.587 50 40 FFGB COc1cc(/C=N/NC(=O)c2cccnc2)cc(Br)c1OC 4702563 KEZSBKCWIWPNBI-QGMBQPNBSA-N 364.199 2.625 50 40 FFGB CSc1ccc(/C=N/NC(=O)CN2C[C@H](c3ccccc3)CC2=O)cc1 408974306 YYIARVRESTVWOH-KKJJZKEWSA-N 367.474 2.875 50 40 FFGB COc1cccc(NCC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1 12532935 SHSAGFPVZVMTNQ-LBPRGKRZSA-N 373.478 2.755 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2cccs2)cc1NC(=O)c1ccco1 9883006 ADAGLGSSONQASS-UHFFFAOYSA-N 369.402 2.977 50 40 FFGB Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)oc2c(F)cccc12 7957560 RCGXJMGDEVLESS-UHFFFAOYSA-N 356.309 2.684 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1ccc(OCc2cccc(C(=O)O)c2)cc1 408773776 SMIMPNYHYVPGFC-YVLHZVERSA-N 350.374 2.959 50 40 FFGB O=C(CCl)N1CC[C@H](CN(C(=O)OCc2ccccc2)C2CC2)C1 79412103 ADOJEUOCOVEFMK-HNNXBMFYSA-N 350.846 2.875 50 40 FFGB CC1=C(C)C[C@@H](C(=O)O)[C@@H](C(=O)NNC(=O)c2cccc(Cl)c2)C1 5044983 YESXGRJZKOEVKU-UONOGXRCSA-N 350.802 2.548 50 40 FFGB COc1cccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c1 100191767 FAMREHJCNZQNEU-MRXNPFEDSA-N 358.353 2.836 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)COc3ccc(C)cc3)ccc21 2658284 IXHDYRCVGZYQSI-UHFFFAOYSA-N 366.421 2.513 50 40 FFGB Cc1noc(CSc2ccccc2C(=O)NNC(=O)C2CCCC2)n1 47451824 AAGKSZCSTQCHTL-UHFFFAOYSA-N 360.439 2.622 50 40 FFGB CCCCn1c(SCC(=O)/C(C#N)=C(/C)N)nc2ccccc2c1=O 104700151 VWJDFTYPCONKHM-OWBHPGMISA-N 356.451 2.614 50 40 FFGB Cc1c(C(=O)NNC(=O)c2cncc(Br)c2)oc2ccccc12 12682005 USPQCSGLLLGSFY-UHFFFAOYSA-N 374.194 2.974 50 40 FFGB C/C(CCc1ccccc1)=N\NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 58885905 DOLBFMZKAKCOKE-DEDYPNTBSA-N 354.366 2.658 50 40 FFGB COCc1cc(C)nc(OCC(=O)N/N=C/c2ccc(Cl)cc2)c1C#N 2293364 LLTAKRFZYWXLSV-ZVBGSRNCSA-N 372.812 2.591 50 40 FFGB C/C(=C\C(=O)C(F)(F)C(F)(F)F)NNC(=O)c1ccc(N(C)C)cc1 4549385 JTGRJXIPHILYRQ-CMDGGOBGSA-N 365.302 2.658 50 40 FFGB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\NNC(=O)c1ccccc1 95471506 WELKQYAVDDDJRC-WJDWOHSUSA-N 354.797 2.881 50 40 FFGB CCc1ccc(OCC(=O)N/N=C/c2cc(OC)c(OC)cc2OC)cc1 3323808 YVOAHJWGQQIPAH-CIAFOILYSA-N 372.421 2.804 50 40 FFGB Cc1cccc(O[C@H](C)C(=O)NNc2ncc(Br)cn2)c1C 11914469 HIILMSTYOISPMP-LLVKDONJSA-N 365.231 2.767 50 40 FFGB Cc1cn2c(/C=C/C(=O)NNC(=O)c3ccccc3C)c(C)nc2s1 84234633 KZHHXDCBZNQLJG-CMDGGOBGSA-N 354.435 2.795 50 40 FFGB C/C(=N\NC(=O)COc1c(C)cccc1C)c1ccc2c(c1)OCCO2 4458621 OEBDFTGTQPXVHZ-RCCKNPSSSA-N 354.406 2.994 50 40 FFGB O=C(O)c1cccc(-c2ccc(/C=N/NC(=O)[C@@H](O)c3ccccc3)o2)c1 5647679 GDIJOLLUZZBBLB-IUOVYFEOSA-N 364.357 2.829 50 40 FFGB CSc1nc(=N)n2c(c1C#N)S[C@H]1CCC[C@H](Br)[C@H]12 409415749 NFRNZRKDQMENFF-XHNCKOQMSA-N 357.302 2.919 50 40 FFGB CCOc1ccc([C@H](O)CCC(=O)N/N=C/c2ccc(N(C)C)o2)cc1 83301677 OSIZXSRBOIMRDT-UOBPLZBXSA-N 359.426 2.708 50 40 FFGB Cc1cc(C)n2nc(C(=O)N/N=C/c3ccc(Cl)c(Cl)c3)nc2n1 1081952 AETCKGFXHFOSMN-CNHKJKLMSA-N 363.208 2.812 50 40 FFGB Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 3084646 HDJFIXZZIVVVGC-GIJQJNRQSA-N 360.757 2.645 50 40 FFGB O=C(CCCCCNC(=O)c1ccccc1)N/N=C/c1ccc(O)cc1O 2271257 KUXVXHJYHFALKB-HYARGMPZSA-N 369.421 2.538 50 40 FFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C/c1cc2c(cc1Cl)OCO2 7003707 RJAQSNQKZQXBCY-AWQFTUOYSA-N 374.780 2.533 50 40 FFGB CC1=C(C)[C@@H](NNC(=O)c2ccc(F)cc2)N(Cc2ccc(F)cc2)C1=O 199412953 LJBJCPNKAPXZHA-SFHVURJKSA-N 371.387 2.904 50 40 FFGB O=S(=O)(NCc1nc(C2CC2)no1)c1ccc(CCCCl)cc1 97212258 IRFQIBLUPDTCDJ-UHFFFAOYSA-N 355.847 2.597 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc3c(c2)OCCO3)cc1 5489339 VMXIAUDZBMEFRZ-VBKFSLOCSA-N 372.402 2.717 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)COc2ccc(Cl)c(C)c2)c1 6504357 KUNKETCMZIUVSK-UHFFFAOYSA-N 362.813 2.562 50 40 FFGB O=C(CNc1nc2ccccc2s1)NNC(=O)Cc1ccc(Cl)cc1 12808497 HZMNEJCIVVTAKX-UHFFFAOYSA-N 374.853 2.752 50 40 FFGB COc1ccc([C@H]2Nc3ncnn3C(N)=C2C#N)cc1OCc1ccccc1 18199287 KDHXGDFRWIXHLG-GOSISDBHSA-N 374.404 2.683 50 40 FFGB CCOc1cc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)ccc1O 409322612 MFFGIDDATNNOPW-NDENLUEZSA-N 358.394 2.962 50 40 FFGB COc1cccc2cc(C(=O)N/N=C/c3ccc(N4CCOCC4)o3)oc12 409016862 TZZXMLAWJVTMRZ-UDWIEESQSA-N 369.377 2.635 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)CCc1ccccc1 408866771 GNESNDOEVCVDDX-XDHOZWIPSA-N 357.366 2.695 50 40 FFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1 38536879 CPONQNKAJJUPOH-FKTQOLNDSA-N 356.422 2.840 50 40 FFGB O=C(COc1ccccc1)OC[C@@H](Br)CBr 1676063 QFFFMOXFOFHBOX-VIFPVBQESA-N 352.022 2.767 50 40 FFGB Cc1ccc([C@H]2CC(=O)NC(SCC(=O)N3CCCC3)=C2C#N)cc1 639248 WMTHOOJUATUUNX-OAHLLOKOSA-N 355.463 2.689 50 40 FFGB Cc1cc(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2O)ccc1Cl 3140043 REKQUPXWAIBELU-QGMBQPNBSA-N 363.757 2.791 50 40 FFGB C=C1C(=O)O[C@@H]2/C=C(\C)CC/C=C(/C=O)[C@H](OC)[C@@H](OC(=O)C(C)C)[C@@H]12 100067193 SKCDPGIEMVQDCR-QZSWEDNISA-N 362.422 2.532 50 40 FFGB biogenic,in-vitro COC(=O)/C(C#N)=C/c1cc(Br)cc(Br)c1O 3338743 AQSVOTBFVRMAKD-FARCUNLSSA-N 360.989 2.997 50 40 FFGB CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)NNC(=O)c2ccco2)CC1=O 12926490 URURFYZFMNUGQA-KBPBESRZSA-N 369.421 2.607 50 40 FFGB COc1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)ccc1O 18201253 ASTKOVTVBDBHEK-MRXNPFEDSA-N 374.352 2.542 50 40 FFGB COc1ccc(C(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)cc1OC 409056793 IHIURINLOOSVKU-UHFFFAOYSA-N 358.316 2.508 50 40 FFGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(O)c(Br)c1 409225164 JOJKYJUHBALILC-NVMNQCDNSA-N 351.175 2.987 50 40 FFGB CCOC(=O)COc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc1 216040174 WMYQBAOOOKCDTJ-XKZIYDEJSA-N 368.433 2.938 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1ccc(Cl)cc1 36159364 MOGSFGDIYRPXHH-FRKPEAEDSA-N 364.701 2.626 50 40 FFGB COc1cccc(NC(=O)/C(C#N)=C/c2cc(OC)c(O)c(OC)c2)c1 3265897 WAFWAEKLNWGXCN-NTUHNPAUSA-N 354.362 2.964 50 40 FFGB COc1ccc(Br)cc1[C@H]1C(C#N)=C(N)Oc2[nH]nc(C)c21 5013109 FOUHMRCYXVDFKG-ZDUSSCGKSA-N 361.199 2.707 50 40 FFGB Cc1cc(C)cc(OCC(=O)N/N=C\c2cc([N+](=O)[O-])cc(C)c2O)c1 18210764 DTUWRVFDMFNGSX-OCKHKDLRSA-N 357.366 2.755 50 40 FFGB Cc1cccc(NCC(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2O)c1 5448377 IJKMIWXGNJFOGG-WSDLNYQXSA-N 363.421 2.757 50 40 FFGB O=C(N/N=C/c1cc(Cl)cc(Br)c1O)c1cccnc1 4679509 QSLFYYQBVAIFHP-REZTVBANSA-N 354.591 2.967 50 40 FFGB CCCc1n[nH]c2c1[C@H](c1c(OC)cc(OC)cc1OC)C(C#N)=C(N)O2 4755500 XNZVZACVZNCWEI-OAHLLOKOSA-N 370.409 2.606 50 40 FFGB NC(=O)Cn1cc(/C=N/NC(=O)c2ccc(Cl)cc2)c2ccccc21 6258135 JEZNKGKKRMADFF-ZVBGSRNCSA-N 354.797 2.544 50 40 FFGB Cc1ccc2c(CC(=O)NNC(=O)c3[nH]nc4c3CCCC4)coc2c1C 8710265 IMPMLEGDOCFPBI-UHFFFAOYSA-N 366.421 2.655 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@@H]1CC(=O)N(c2ccc(C)cc2)C1 4703038 ACMXEYFCIMHNKC-SVZNOHIVSA-N 351.406 2.507 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)cc1 408866978 IGUSFUQPLIOIML-LDEZXBAHSA-N 358.438 2.905 50 40 FFGB COc1cccc(Cn2c(=O)c3ccccc3n3c(CCl)nnc23)c1 408712765 ONQJDVMAHARNAW-UHFFFAOYSA-N 354.797 2.840 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccccc2C(=O)O)cc1 223174231 VIRSPRYWBOKJJE-UVTDQMKNSA-N 350.330 2.717 50 40 FFGB O=C(N/N=C/c1cccc(I)c1)c1ccccc1O 3157869 OPZBZOIMNSMHMR-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)cc1 13477183 XCXFYJFWWGFOCF-KEBDBYFISA-N 360.797 2.964 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)C23CC4C[C@H](CC[C@H](C4)C2)C3)cc1 17050971 OLWHVTKPNBOHAP-JOUKPKRSSA-N 362.495 2.911 50 40 FFGB O=C(CNC(=O)c1cc(Cl)ccc1Cl)N/N=C/c1cccs1 2451462 YAQNCPJMZGBMMG-CNHKJKLMSA-N 356.234 2.935 50 40 FFGB CC(C)Oc1ccc(/C=N/NC(=O)c2ccc(CN3CCOCC3)o2)cc1 20025464 JLGPQNCQKIHFOQ-FYJGNVAPSA-N 371.437 2.663 50 40 FFGB CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)cc1 1092804 IFUAAOVJKBMHIY-INIZCTEOSA-N 353.426 2.620 50 40 FFGB CC(C)(C)c1ccc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 4657043 SBBAJMBSEDKDEB-UHFFFAOYSA-N 371.393 2.732 50 40 FFGB COc1ccc(CNS(=O)(=O)c2ccc(CCCl)cc2)cc1OC 32935901 ADPXRDLJRVWWRN-UHFFFAOYSA-N 369.870 2.964 50 40 FFGB CN1C(=O)/C(=N/NC(=O)c2ccc(Br)cc2)c2ccccc21 13550333 SYCJFXBJQWKIOF-NBVRZTHBSA-N 358.195 2.560 50 40 FFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3ccccc3OC)CC2=O)cc1 6843660 YZUANCFZBKFKFE-VYZAVGSRSA-N 365.433 2.761 50 40 FFGB Cc1cc([N+](=O)[O-])cc2c1NC(=O)/C2=N\NC(=O)c1ccccc1Cl 12445821 NJNOQFAZCAJZIK-UHFFFAOYSA-N 358.741 2.643 50 40 FFGB CCOc1ccc(NC(=O)C(=O)N/N=C\c2c(F)cccc2Cl)cc1 59444786 DOCDUNONNALRCC-JMIUGGIZSA-N 363.776 2.967 50 40 FFGB O=C(NNC(=O)c1cccs1)N[C@@H](c1ccccc1)c1ccccn1 29327864 IKXOASOBWOYZRC-INIZCTEOSA-N 352.419 2.877 50 40 FFGB C#CCOc1cccc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)c1 409320318 CSWNCANTQNPWNB-STZFKDTASA-N 352.390 2.870 50 40 FFGB C[C@@H](NC(=O)C(=O)N/N=C/c1c(O)ccc2ccccc12)c1ccccc1 3049722 OGRIBPGJCFOLME-CYGNYLSHSA-N 361.401 2.873 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2ccccc2)c(Br)c1 1431170 KJMDJUOYLMHHLH-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB Cc1ccc(-n2ncc3c(NNC(=O)c4cccc(O)c4)ncnc32)cc1 7393221 JMDDDXPYHKARFA-UHFFFAOYSA-N 360.377 2.586 50 40 FFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3cccs3)CC2=O)cc1 6962951 ZURXTVMTKWNBEJ-OTGIAGGSSA-N 357.435 2.650 50 40 FFGB O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)[C@H]1COc2ccccc2O1 2252610 IRXLKBDYWFIHOB-TZMAJHSYSA-N 367.188 2.989 50 40 FFGB CCOc1cc(/C=N/NC(=O)COc2ccccc2)ccc1OCC#N 4544380 DZWDPRDYEZRGTQ-FYJGNVAPSA-N 353.378 2.517 50 40 FFGB Cc1ccc(OCC(=O)N/N=C\c2cn(C)c3ccccc23)c([N+](=O)[O-])c1 4740885 IJWXSUZEAQBMFD-JMIUGGIZSA-N 366.377 2.924 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@H]12)N/N=C1/C[C@@H]2C=CC[C@@H]12 17073335 GIRIUIXSQOYDQJ-ZHLHUGOUSA-N 354.454 2.683 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCC1)c1cccc(Cl)c1 20209466 JHNQTVLALHJWQM-UHFFFAOYSA-N 371.890 2.932 50 40 FFGB CC[C@@H](Oc1ccc(C)cc1)C(=O)NNC(=O)c1ccc(OC)c(OC)c1 12137397 VZXALKHQSKAUSH-MRXNPFEDSA-N 372.421 2.631 50 40 FFGB CN1CCN(C(=O)/C(C#N)=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 26967695 ZKDDRVTZDGIKAI-NTCAYCPXSA-N 366.377 2.536 50 40 FFGB COc1ccc(C(=O)NNc2nc(C)cc(C)n2)cc1Br 11334312 RKTRIQHXIFJBEI-UHFFFAOYSA-N 351.204 2.621 50 40 FFGB CCCCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 409146210 SBUWRXGYGJNWBH-HYARGMPZSA-N 353.422 2.632 50 40 FFGB O=C(CCC(=O)N/N=C/[C@@H]1C[C@H]2CC[C@H]1C2)N/N=C/[C@H]1C[C@H]2CC[C@H]1C2 103623206 NXDNIKYHOJFYMV-QTHIIVCASA-N 358.486 2.843 50 40 FFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc(C)s3)CC2=O)cc1 2232983 FOELUROXHAKMOI-XLTHYULKSA-N 371.462 2.958 50 40 FFGB Cc1cc2c(c(=O)n1C)[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 4248288 HAPFDQXKNWJAFE-CQSZACIVSA-N 372.222 2.674 50 40 FFGB N#CC1=C(SCC(=O)NCc2ccco2)NC(=O)C[C@@H]1c1ccccc1 6496144 MTSDCUSDEOXHKE-OAHLLOKOSA-N 367.430 2.668 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1cccc(Br)c1 8381229 LDDYVNWMQVERIG-UHFFFAOYSA-N 364.268 2.758 50 40 FFGB C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1nc2ccccc2s1 105557068 DHXGCTYGPMGXLN-BBJIBYMTSA-N 353.403 2.977 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2ccc(OCC)cc2)cc1 20763814 UQERCTUFERQCBN-FYJGNVAPSA-N 370.405 2.791 50 40 FFGB C/C(=N/NC(N)=O)c1ccc(-c2sc([N+](=O)[O-])cc2[N+](=O)[O-])s1 9183570 ZSFIVBWDSUXNFW-ACAGNQJTSA-N 355.357 2.685 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccccc2C)c1C 408946619 ZBNHQDQBDIHKPD-OMBDHMDGSA-N 354.454 2.767 50 40 FFGB O=C(N/N=C/c1cc(Cl)ccc1Cl)c1cnc2ccccn2c1=O 9452611 UOMJRHHGDZTLAA-DNTJNYDQSA-N 361.188 2.765 50 40 FFGB Cc1ccc(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)c(C)c1 8474744 HNVOSKZUPCGDGB-YQBXUVTMSA-N 364.239 2.813 50 40 FFGB CC(C)(C)[Si](C)(C)Oc1cccc2c1CN([C@H]1CCC(=O)NC1=O)C2=O 2362803197 MNBBVQMRQVKNLZ-AWEZNQCLSA-N 374.513 2.832 50 40 FFGB Cc1cc(OCC(=O)n2cc(C(=O)NN)c3ccccc32)ccc1Cl 216750319 LLXCEUGCLGKUSR-UHFFFAOYSA-N 357.797 2.926 50 40 FFGB CCc1sc(C(=O)NNC(=O)c2ccccc2-n2cccn2)cc1C 40144596 DOYHEDYFQZVLKQ-UHFFFAOYSA-N 354.435 2.879 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)N/N=C1/C(=O)Nc2ccc(F)cc21 5093933 BOIZXGDTNBDZMD-UHFFFAOYSA-N 361.760 2.639 50 40 FFGB O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)cc1 2163253 XBKNLDMWMOUDNH-UHFFFAOYSA-N 354.149 2.976 50 40 FFGB CCOC(=O)/C(C#N)=C/c1cn(CCC(=O)O)nc1-c1ccc(OC)cc1 3273781 FCWHIELKFUQLGG-GXDHUFHOSA-N 369.377 2.503 50 40 FFGB COc1ccc(CNC(=S)NNC(=O)c2cc3ccccc3o2)cc1 887338 KQEUPOYYHMJDHY-UHFFFAOYSA-N 355.419 2.751 50 40 FFGB O=C(/C=C/c1ccco1)NNC(=O)COc1ccc(Cl)cc1Cl 1794807 PDSGDACIKRLEPA-GQCTYLIASA-N 355.177 2.826 50 40 FFGB O=C(NC[C@@H]1CCCO1)NNC(=O)c1c[nH]cc1-c1ccc(Cl)s1 65145831 HPNXGZHPZJREIM-VIFPVBQESA-N 368.846 2.520 50 40 FFGB CC(=O)c1c(NNC(=O)c2ccccc2Br)oc(C)cc1=O 4604680 MDANCCFBOCSFAI-UHFFFAOYSA-N 365.183 2.670 50 40 FFGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccc(OC)cc1 15423077 WKVIJNNZKOLNDW-CYBMUJFWSA-N 357.248 2.704 50 40 FFGB COc1cc(/C=N\NC(=O)COc2ccc(C)cc2C)cc(OC)c1O 30843509 VQTXDDMKWACBGA-JMIUGGIZSA-N 358.394 2.555 50 40 FFGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccc([N+](=O)[O-])cc1 1434591 BMNPRQNVFCKPRZ-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB Cc1nc2cc(C(=O)NNC(=O)c3ccncc3)ccc2n1-c1ccccc1 12525732 RDXKZCSQDYBVPA-UHFFFAOYSA-N 371.400 2.804 50 40 FFGB Cc1cccc2c(=O)cc(C(=O)NNC(=O)c3ccc(Cl)cc3)oc12 27994817 XPLDRKIAVHABOA-UHFFFAOYSA-N 356.765 2.830 50 40 FFGB COc1cc(/C=N/NC(=O)CSc2ccccc2)cc([N+](=O)[O-])c1O 36729122 FHLLMVBWGDQHLJ-RQZCQDPDSA-N 361.379 2.551 50 40 FFGB COc1ccc2nc(/C=N/NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)ccc2c1 15975096 GHVIJXUCZKWOGA-ZICWZVMQSA-N 372.425 2.607 50 40 FFGB O=C(N/N=C/c1ccc(O)cc1O)c1ccc(NC(=O)c2ccco2)cc1 6334182 PMBSUBNZAFQCHK-RGVLZGJSSA-N 365.345 2.707 50 40 FFGB COC(=O)/C(C#N)=C/c1c(Oc2ccc(C)cc2)nc2ccccn2c1=O 4205349 WGAHBANSDSKCQA-SDNWHVSQSA-N 361.357 2.875 50 40 FFGB O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)[C@H]1CCCO1 107338769 SKERKCBMOPMQLZ-VNHYZAJKSA-N 371.462 2.673 50 40 FFGB COCc1n[nH]c2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 4592555 ZOCPMJWOVAWFMI-LBPRGKRZSA-N 361.199 2.537 50 40 FFGB CC1=C(C(=O)Nc2ccccc2)[C@H](c2cccnc2)N2NC=C(C#N)C2=N1 8993595 UJDBWUFBTWLMPN-SFHVURJKSA-N 356.389 2.675 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1ccc(Br)cc1 4763201 NRPGVEBFLAZGQX-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCC1)c1ccc(Cl)cc1 20209642 IPWOVXYRCNSMLU-UHFFFAOYSA-N 371.890 2.932 50 40 FFGB CCN(NC(=O)C[C@@H](NC(N)=O)c1cccc(C)c1)c1ccc(C)cc1 32423651 BXEVFSOXMNGMPA-GOSISDBHSA-N 354.454 2.961 50 40 FFGB O=C(COc1ccc(Cl)cc1)N/N=C/c1ccn(CC(F)(F)F)n1 252507027 WFGSYGYCHMCAMG-FBCYGCLPSA-N 360.723 2.628 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@H]2CC=C[C@H]12)N/N=C1\C[C@@H]2CC=C[C@@H]12 5725503 KVMHVJCPUHROLG-IILYWGAISA-N 354.454 2.683 50 40 FFGB C/C(=N\NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)c1ccncc1 5180461 XTDRFEXKSJPTMX-AWQFTUOYSA-N 351.193 2.867 50 40 FFGB O=C(CCS(=O)(=O)C1CCCC1)NNc1ccccc1C(F)(F)F 40145329 YYPFVOGXPVMKMS-UHFFFAOYSA-N 364.389 2.896 50 40 FFGB O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1Cl 840341 XNLGDXQAZZHAQH-UHFFFAOYSA-N 354.149 2.976 50 40 FFGB C[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NNc1ccncc1 1467734 DWGHLAFUWNVXBL-MRXNPFEDSA-N 374.444 2.862 50 40 FFGB CCCCc1[nH]nc2c1[C@@H](c1cc(OC)c3c(c1)OCO3)C(C#N)=C(N)O2 8783260 HBVIXPDQBSHIRL-HNNXBMFYSA-N 368.393 2.708 50 40 FFGB biogenic,in-vitro Cn1c2[n+](c3sc4c(c3c1=O)CCCC4)[C@H](CBr)CS2 51353972 SCDFZTFNXNXUJH-MRVPVSSYSA-N 372.333 2.808 50 40 FFGB O=C(Cc1cccc2ccccc12)NNS(=O)(=O)c1ccc(F)cc1 12797537 QYPXREMTTUEJKU-UHFFFAOYSA-N 358.394 2.531 50 40 FFGB C/C(=N\NC(=O)Cn1c(C(F)(F)F)nc2ccccc21)c1ccccn1 7738274 MISLXCZVHXWPLL-FOKLQQMPSA-N 361.327 2.991 50 40 FFGB COC(=O)c1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)N(C)C)c1C 59334448 XERBXIBSKNTDRP-WJDWOHSUSA-N 351.406 2.876 50 40 FFGB C/C(CC(=O)Nc1ccc([N+](=O)[O-])cc1)=N/NC(=O)C1[C@@H]2CCCC[C@@H]12 100505501 IVOGQQSWWHBBJF-ORIIPDEJSA-N 358.398 2.852 50 40 FFGB O=C(COc1cccc2ccccc12)N/N=C\c1cccc([N+](=O)[O-])c1O 409068195 HRYFVUSMLQDIFP-JAIQZWGSSA-N 365.345 2.983 50 40 FFGB COc1cc2c(cc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1)OCO2 408541067 DOCSLMPRBUYSBZ-ACAGNQJTSA-N 366.329 2.668 50 40 FFGB CC(C)(C)c1cc(C(=O)N/N=C/c2cc(Cl)cc([N+](=O)[O-])c2O)n[nH]1 38166167 WHUURCMQVZERQS-REZTVBANSA-N 365.777 2.738 50 40 FFGB CC(C)(C)c1ccc(C(=O)NNC(=O)c2cn(-c3ccccc3)nn2)cc1 40074809 PUIPUEAUPGZOER-UHFFFAOYSA-N 363.421 2.640 50 40 FFGB O=C(Nc1ccccc1)SCCC[Si]12OCCN(CCO1)CCO2 195550546 ZCKCCKWMYNQVJL-UHFFFAOYSA-N 368.531 2.660 50 40 FFGB Cc1ccc(/C=N/NC(=O)c2ccn(Cc3ccc([N+](=O)[O-])cc3)n2)cc1 1089371 KOVUFYJNLXLUDQ-UDWIEESQSA-N 363.377 2.912 50 40 FFGB Cc1ccc(NCC(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2O)cc1 5426585 DYHNYLAEDRWGOM-WSDLNYQXSA-N 363.421 2.757 50 40 FFGB C/C(=N/NC(=O)CCC(=O)N/N=C(\C)c1ccccc1)c1ccccc1 4416203 PQRQNFMPMZRTLJ-KBNZVFGVSA-N 350.422 2.847 50 40 FFGB Cc1ccc(CSCC(=O)N/N=C/c2ccc(N3CCOCC3)o2)cc1 408994918 HVKAPBDLTCGZCM-UDWIEESQSA-N 373.478 2.808 50 40 FFGB Cc1cc(C)nc(SCC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n1 5788278 IVVBGIDXRJUCCR-UHFFFAOYSA-N 374.510 2.549 50 40 FFGB C[C@@H](SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1)C(=O)Nc1ccccc1 7252407 GXFTUMNLZBYUMN-DGCLKSJQSA-N 354.435 2.778 50 40 FFGB COc1ccc(/C=C(\NC(=O)c2ccc(C(C)(C)C)cc2)C(=O)NN)cc1 15944904 HZGPCCIXXVKMRE-AQTBWJFISA-N 367.449 2.754 50 40 FFGB Cc1ccc(-c2nnc(CCC(=O)NNC(=O)c3cccc(C)c3)o2)cc1 9314644 AXIFQCJCDMDINT-UHFFFAOYSA-N 364.405 2.747 50 40 FFGB CN1/C(=C(\C#N)C(=O)c2cccc(N3C(=O)CCC3=O)c2)Nc2ccccc21 11667510 AFMULJQWTCNQJG-RCCKNPSSSA-N 372.384 2.820 50 40 FFGB CC[C@@H](Oc1ccc(C)cc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 12137405 SUPVRKRRJYWKNX-MRXNPFEDSA-N 357.366 2.522 50 40 FFGB CCc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 1211251 HWDCCBUXCADILZ-NEIHUHTASA-N 365.433 2.761 50 40 FFGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(NC(C)=O)cc2)cc1 59514911 GTTQWUKNBYHNFW-UDWIEESQSA-N 352.394 2.757 50 40 FFGB CCCOc1ccc(C(=O)N/N=C/c2cc(OC)cc([N+](=O)[O-])c2O)cc1 20197231 QJVKYIFYODHKIP-YBFXNURJSA-N 373.365 2.862 50 40 FFGB CC(C)(C)OC(=O)COc1ccc(/C=N/NC(=O)c2ccncc2)cc1 408831690 WJZNLPGUIDDKIT-CIAFOILYSA-N 355.394 2.566 50 40 FFGB C=CCOc1ccc([C@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1OC 409132200 LTOCGNNZUIJDQV-IBGZPJMESA-N 365.433 2.990 50 40 FFGB CC(/C=N\NC(=O)CN1CCN(Cc2ccccc2)CC1)=C\c1ccco1 36093681 LGRPCGDYYMASJQ-KCZZZHDASA-N 366.465 2.603 50 40 FFGB Cc1ccc(/C=N\NC(=O)CCCCC(=O)N/N=C\c2ccc(C)o2)o1 48860909 BLMZAKYFIXMEGU-YZLQMOBTSA-N 358.398 2.650 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)NCc2ccc(F)cc2)cc1 5289177 UJAAARLLLIYGKB-LPYMAVHISA-N 357.385 2.647 50 40 FFGB Cc1ccc(C(=O)NNc2cc(N3CCCC3)nc(N3CCCC3)n2)cc1 842943 AVHYTXJNAXLTFO-UHFFFAOYSA-N 366.469 2.742 50 40 FFGB CCO[C@H](C)n1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253396842 FBWOQDNOLOKQAK-BZNIZROVSA-N 356.426 2.889 50 40 FFGB CCOc1ccccc1OCCC(=O)NNC(=O)c1ccc(Cl)cc1 2638615 GZKQGEMGZIPWJF-UHFFFAOYSA-N 362.813 2.969 50 40 FFGB CN(c1ccccc1)c1ccc(/C=N/NC(=O)C(=O)N2CCCC2)cc1 59461412 SZBVTZHKMGXAJD-RCCKNPSSSA-N 350.422 2.527 50 40 FFGB COc1cc2c(cc1/C=N\NC(=O)c1cc3cccc(OC)c3o1)OCO2 4703680 AAUMVXYWKLJYNV-UKWGHVSLSA-N 368.345 2.943 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)N/N=C\c1ccc([N+](=O)[O-])c(O)c1 30802463 MXSQFPAHFWJXFX-LSCVHKIXSA-N 363.757 2.791 50 40 FFGB N#CC1=C(N)Oc2cc(N)ccc2[C@H]1c1cc(Br)ccc1O 16788559 AWVPTFNJQKQMDZ-HNNXBMFYSA-N 358.195 2.955 50 40 FFGB C/C(Cc1ccccc1)=N\NC(=O)CNC(=O)Cc1ccc(Cl)cc1 5024374 DULIIBINJJDACZ-HYARGMPZSA-N 357.841 2.734 50 40 FFGB C/C(=N\NC(=O)Cn1nc(C)cc1C)c1ccc(Br)s1 6686923 MXNYJYWQHBACSM-XNTDXEJSSA-N 355.261 2.864 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(F)cc2)c1C 408972366 SEAQCIROUUJZOQ-CIAFOILYSA-N 358.417 2.552 50 40 FFGB CN(C)c1ccc(/C=N\NC(=O)c2ccccc2NC(=O)C2CC2)cc1 31723669 ABTGZYJSUVSTMB-BKUYFWCQSA-N 350.422 2.865 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 1211805 VLRWCHUISUKXQQ-KOWBDXASSA-N 365.433 2.897 50 40 FFGB CN(NC(=O)CNC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccccc1 8358274 QBXODBDIKDAKMB-UHFFFAOYSA-N 355.482 2.877 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc(OC)ccc2OC)cc1 120104159 SUZVSLRZBVSQQT-YBEGLDIGSA-N 352.390 2.936 50 40 FFGB C/C(CC(=O)NCC(C)C)=N\NC(=O)c1ccccc1Br 4904433 LIBNXVWUTVCAKT-WOJGMQOQSA-N 354.248 2.717 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cn(C)c3ccccc23)n1 6964291 DKRPURYAPCFOSA-DJKKODMXSA-N 353.451 2.828 50 40 FFGB COc1cc(/C=N/NC(=O)COc2cccc(C)c2)cc(OC)c1OC 3087595 YZDKFWKAFVHQBB-RGVLZGJSSA-N 358.394 2.550 50 40 FFGB O=C(Cc1ccc(Cl)cc1)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 59419190 AXIBINFURZSBJC-QGMBQPNBSA-N 361.741 2.670 50 40 FFGB N#CC(C#N)=Cc1ccc(OS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 6222496 CAZLGXFAFVMFQA-UHFFFAOYSA-N 355.331 2.793 50 40 FFGB Cc1cc(C(=O)CCC(=O)NNC(=O)c2ccc3c(c2)OCO3)c(C)s1 6560157 PLYBKOIOCYGWFX-UHFFFAOYSA-N 374.418 2.518 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Br)c1O 33361082 MGODDYATSIEQHB-WZUFQYTHSA-N 353.216 2.985 50 40 FFGB Cn1ncc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1C(F)(F)F 253408989 ZFCFLGPFONDJFB-LBPRGKRZSA-N 366.343 2.890 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)N(C)c2ccccc2)c(OC)c1 102018324 KSWAMDJXDCNJJU-KGENOOAVSA-N 369.421 2.863 50 40 FFGB N#CC1=C(SCC(=O)N2CCCCC2)NC(=O)C[C@H]1c1ccccc1 6496085 BFIIIRYTFMULDB-HNNXBMFYSA-N 355.463 2.771 50 40 FFGB O=C1Nc2ccccc2[C@@H]1/C=N\NC(=O)C(F)(F)C(F)(F)C(F)(F)F 100303143 KOYVEZNWEZDYTA-DLJTWHBXSA-N 371.212 2.657 50 40 FFGB O=C(CI)Nc1ccc(Br)cc1F 72226294 DEUHVDSAYZIOFD-UHFFFAOYSA-N 357.948 2.962 50 40 FFGB Nc1ccc(C(=O)NN2C(=O)[C@@H](Cl)[C@@H]2c2ccccc2Cl)cc1 5581736 UREJEGPGLHQRMX-KBPBESRZSA-N 350.205 2.758 50 40 FFGB CC(C)c1n[nH]c2c1[C@]1(C(=O)Nc3ccc(Cl)cc31)C(C#N)=C(N)O2 9009097 YOEXACYXZFKODF-QGZVFWFLSA-N 355.785 2.511 50 40 FFGB COc1cc(/C=N\NC(=O)c2cnccn2)ccc1OCc1ccccc1 30702691 UVBCPJSQIZIFHA-FMCGGJTJSA-N 362.389 2.828 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)COc2ccc3ccccc3c2)c1 4713812 WYPZIGHMMWEVMZ-UHFFFAOYSA-N 364.401 2.753 50 40 FFGB O=C(N/N=C/c1cc(Cl)ccc1Cl)c1nc2ccccc2c(=O)[nH]1 4865269 NBYBNYZYDVUNGN-UFWORHAWSA-N 361.188 2.994 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F 6208718 LBRSSRJYBNKFRH-SNVBAGLBSA-N 366.776 2.716 50 40 FFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C\c1c(F)cccc1Cl 59444788 XPRAJGOEEVRYSV-UKWGHVSLSA-N 363.776 2.885 50 40 FFGB O=C(NNC(=O)c1cc2c(s1)CCC2)c1ccc(NC(=O)C2CC2)cc1 17445351 OEXLUEIOTWGWNN-UHFFFAOYSA-N 369.446 2.660 50 40 FFGB COc1cc(Br)cc(/C=C(/C#N)C(=O)NC(C)C)c1OC 33779190 YTLCABFQEKAYQZ-WZUFQYTHSA-N 353.216 2.898 50 40 FFGB CCN(CC)N(C(C)=O)[C@@H]1C[C@@H](c2ccccc2)C(C#N)(C#N)C1(C#N)C#N 2273536 APBGEMOUPARITI-RBUKOAKNSA-N 374.448 2.715 50 40 FFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1cc(Br)ccc1O 1501470 WAKLBJCNKLZDJN-REZTVBANSA-N 363.167 2.647 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2ccccn2)c(C)n1-c1ccc(F)cc1 12734350 PITYLXSURPXMIZ-UHFFFAOYSA-N 352.369 2.703 50 40 FFGB CCN(CC)S(=O)(=O)c1ccc(Cl)c(NC(=O)[C@H](C)Cl)c1 3887312 DBSVVISNWNONNM-VIFPVBQESA-N 353.271 2.936 50 40 FFGB COc1ccccc1/C=N\NC(=O)[C@@H](NC(=O)Cc1cccs1)C(C)C 17150257 ZSCWRUPPVWQKHT-HRVJUDJTSA-N 373.478 2.590 50 40 FFGB CC(C)C/C(=N\NC(=O)CNC(=O)/C=C/c1ccco1)c1ccccc1 5005633 VUNBNBXUSIGYOR-KGCMIBIPSA-N 353.422 2.976 50 40 FFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CO/N=C/c2ccccc2)cc1 5612605 CYVUCFLVCUPENU-DWHBXHIASA-N 352.394 2.536 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)C2(c3ccccc3)CCC2)cc1OC 32904142 SVPKXPZQHVPBJN-UHFFFAOYSA-N 368.433 2.977 50 40 FFGB CC(C)C(=O)NNC(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 95456154 MEYIJYKLXSQIQC-SANMLTNESA-N 373.478 2.944 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 59401674 SZGWUXJMMRVQNI-DEDYPNTBSA-N 368.393 2.504 50 40 FFGB NC(=O)c1cc2cc(Cl)ccc2o/c1=N/NC(=O)c1cccc(F)c1 12719947 LTGHIPYRVYIBLX-OQKWZONESA-N 359.744 2.570 50 40 FFGB CC1=CC(=O)C2=C(C)C[C@H](OC(=O)[C@@H](C)Cl)[C@H]3[C@H](C)C(=O)O[C@@H]3[C@@H]12 4073764 QBCFETYQOSWQTI-ZGRULRJASA-N 352.814 2.569 50 40 FFGB biogenic Cc1cccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccco3)c2)c1 409227766 WMBZZVRTFUHOGZ-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N/N=C1\N=C(N)c2ccccc21 16282798 KBSJFNFDTNUTPG-NSHDSACASA-N 356.813 2.613 50 40 FFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(N(C)C)cc2)c1C 18102890 UTFQURBNFZFSEZ-HNNXBMFYSA-N 355.438 2.598 50 40 FFGB CC(C)C(=O)NNC(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 95456153 MEYIJYKLXSQIQC-AREMUKBSSA-N 373.478 2.944 50 40 FFGB CCS(=O)(=O)[C@@H](Br)[C@H](O)c1ccc(Br)cc1 96519073 BFGMUYFZUFDMEZ-NXEZZACHSA-N 372.078 2.638 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccccc2C#N)cc1 16137090 WPBSHUADLYLGRV-LPYMAVHISA-N 350.378 2.701 50 40 FFGB CCN1C(=O)/C(=N\NC(=O)Cc2c[nH]c3ccccc23)c2cc(C)ccc21 19636843 OXWONDSKRBSZNK-GFMRDNFCSA-N 360.417 2.906 50 40 FFGB CCCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(/C)NNC(=O)C1CC1 100423282 PZXSNLXUYQKGCT-ATVHPVEESA-N 356.426 2.503 50 40 FFGB Cc1ccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccco3)c2)cc1 8372189 FUAIHCUYFSODKK-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB Cc1ccc(OCC(=O)N/N=C/c2cccc(O)c2)c(Br)c1 1051755 IZOAPXSLJJAUAG-GIJQJNRQSA-N 363.211 2.992 50 40 FFGB C[C@H](NC(=O)NCCNC(=O)[C@@H](C)Cl)c1cccc(C(F)(F)F)c1 65549729 SOVWOOFLXAHZIV-ZJUUUORDSA-N 365.783 2.809 50 40 FFGB NC(=O)N/N=C/c1ccc(OC(=O)c2cc(F)c(F)cc2Cl)cc1 408735404 PRLMGTWTNVHPFJ-IFRROFPPSA-N 353.712 2.840 50 40 FFGB COc1cc(/C=N\NC(=O)c2ccoc2C)cc(Br)c1O 30721748 XLBVSAOIUVJHCC-APSNUPSMSA-N 353.172 2.829 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)Cc2cn3ccsc3n2)c(O)c1 12564190 UEAAZAGJCBFWCQ-VCHYOVAHSA-N 358.423 2.583 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)cc2O)c(OC)c1 107715637 FMTGXCDFYMEDAZ-RGVLZGJSSA-N 358.394 2.961 50 40 FFGB CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3F)[C@@H]2C1 13739101 DASOHEDSKCVXGD-SJLPKXTDSA-N 365.387 2.710 50 40 FFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cccc(OC)c1 408907402 NETPCMYLYHWIPC-SXZORUHJSA-N 369.421 2.503 50 40 FFGB O=C(CNc1ccccc1)N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1 4711932 ATGDXXYOJTXMQW-FYJGNVAPSA-N 363.377 2.948 50 40 FFGB O=C(NC1CC1)[C@H](NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccccc1 15473757 MEQDIBFMBAMXRG-FRXJQHJJSA-N 367.493 2.844 50 40 FFGB O=C(Nc1ccccc1Cl)[C@@H]1[C@@H]2C[C@@H]3[C@@H]1C(=O)O[C@@H]3[C@@H]2Br 4727479 IHRKASQQGMYREB-DLFAJOPRSA-N 370.630 2.850 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc2cccc(O)c2n1 858993 MEVNSFJKRVEADT-YBFXNURJSA-N 350.334 2.541 50 40 FFGB O=C(N/N=C/c1cccc(Cl)c1Cl)c1nc2ccccc2c(=O)[nH]1 6161425 UIWJHPYNOPKZFO-UFWORHAWSA-N 361.188 2.994 50 40 FFGB COCc1noc2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)N2 101965356 NERBYBQRIPUOHI-GFCCVEGCSA-N 361.199 2.835 50 40 FFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccc(C)o2)c1 408590787 QLMSTJVJJLYEDN-FRKPEAEDSA-N 353.172 2.829 50 40 FFGB O=C(N/N=C/c1ccc(Cl)c(Cl)c1)c1ccc(-n2cnnn2)cc1 6786698 DZEKJBMQAPQYCU-QGMBQPNBSA-N 361.192 2.733 50 40 FFGB Cc1ccc(OCC(=O)N/N=C/c2cc(Cl)ccc2O)c([N+](=O)[O-])c1 9355230 QFNAKEJKUYRZSY-QGMBQPNBSA-N 363.757 2.791 50 40 FFGB Cc1ccc(C)c(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)c1 8474751 ISDLBGMHZQLDRI-XYVIHTCUSA-N 364.239 2.813 50 40 FFGB O=C(COc1cccc2ccccc12)N/N=C\c1cc([N+](=O)[O-])ccc1O 38163899 YNZMJZXDTNEJKQ-JAIQZWGSSA-N 365.345 2.983 50 40 FFGB CC1(C)[C@]2(C(=O)O)CC[C@]1(CBr)C(=O)[C@H]2Br 100745945 MFQZVXXGEBQQQI-LIEZGIJOSA-N 354.038 2.605 50 40 FFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=O)c2cccc(C)c2)cc1 5873463 ZJTZZQQRDYFAOQ-UHFFFAOYSA-N 369.421 2.574 50 40 FFGB C=CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1C(=O)OCC 47168772 GQLXQUPYJJPFDI-KAMYIIQDSA-N 351.362 2.685 50 40 FFGB Cc1ccc(C)c(-n2c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c2C)c1 58911376 QOGUJPHMWCPRQE-FSJBWODESA-N 368.481 2.933 50 40 FFGB Cc1cc([N+](=O)[O-])cc(/C=N/NC(=O)COc2c(C)cccc2C)c1O 36245426 APYRPENWDSSBLW-DJKKODMXSA-N 357.366 2.755 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 4481678 BSEFCOIZQZASEX-UDWIEESQSA-N 370.365 2.738 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C/c2cc3c(cc2OC)OCO3)cc1 409083519 BGXJHAZEMFRKPL-NTUHNPAUSA-N 352.346 2.978 50 40 FFGB CCCNC(=O)C(=O)N/N=C/c1cccc(OC)c1Nc1ccccc1C 408708598 RAOUSADSRLPLSQ-LPYMAVHISA-N 368.437 2.724 50 40 FFGB CCN(NC(=O)C[C@H](NC(N)=O)c1ccccc1C)c1ccc(C)cc1 32423650 GRAYGZXVLWWZPZ-SFHVURJKSA-N 354.454 2.961 50 40 FFGB O=C(O)COc1c(Cl)cc(/C=N\NC(=O)c2ccncc2)cc1Cl 36145130 XJPJAUCLJDJYMB-GXHLCREISA-N 368.176 2.616 50 40 FFGB C/C(=N\NC(=O)C(=O)Nc1ccccc1C(=O)O)c1cc2ccccc2o1 226819620 SYCOTFOKNQLICQ-SRZZPIQSSA-N 365.345 2.610 50 40 FFGB COc1cccc(OCC(=O)N/N=C(\C)CC(=O)Nc2ccc(C)cc2)c1 5414823 UMKFMTVSXMLNDD-PXLXIMEGSA-N 369.421 2.903 50 40 FFGB CC(=O)Nc1ccc(/C=N/NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1 3112807 BBOOABVIBUNKIV-AERZKKPOSA-N 373.228 2.928 50 40 FFGB CC1(C)[C@@H](C(=O)NNC(=O)c2ccccc2Cl)CC[C@@]1(C)C(=O)O 3140914 YEASDIDAPOSPIL-DIFFPNOSSA-N 352.818 2.628 50 40 FFGB O=C(NNc1ccccc1)/C(=C\c1cccnc1)NC(=O)c1ccccc1 37868588 ZGMMBJTUNWXGIS-XMHGGMMESA-N 358.401 2.996 50 40 FFGB C/C(=N/NC(=O)CSc1nc2ccccc2n1C)c1ccc(O)cc1 13689258 YIBFOOPJEIIJTB-NDENLUEZSA-N 354.435 2.911 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1Cl 408612937 XMZRSPGRJWWDDX-SRZZPIQSSA-N 359.813 2.505 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc(OC)c1OC 16195158 GPLCQTVAWAIWAD-MDWZMJQESA-N 354.362 2.964 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc(NC(=O)CC)cc2)ccc1O 5416939 XNOCEKPGRUUPCH-UDWIEESQSA-N 355.394 2.903 50 40 FFGB CCOc1cc(/C=N/NC(=O)[C@@H](C)Oc2ccc(C#N)cc2)ccc1O 8499846 FRCHGZYYOWPWQU-LNOXHEFASA-N 353.378 2.580 50 40 FFGB CCCC1=C(C(=O)OCC)[C@@]2(C(=O)Nc3ccc(C)cc32)C(C#N)=C(N)O1 850921 AZQOIZUBXQBDLC-FQEVSTJZSA-N 367.405 2.526 50 40 FFGB C/C(=N\NC(=O)CSc1ncccn1)c1cccc(Br)c1 408732787 YZCHQUUVHVUFDR-VCHYOVAHSA-N 365.256 2.872 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@@H]2C[C@H]2c2ccccc2F)c2ccccc21 70019302 JKDYOPWTHRBKTK-LSDHHAIUSA-N 351.381 2.882 50 40 FFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@@H]1c1ccccc1OC(F)F 9791093 IGNOFDUGPADPLG-GFCCVEGCSA-N 360.744 2.698 50 40 FFGB CN1[C@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@@H](c4cccc(F)c4)[C@H]3[C@H]1CC2 101362235 HSQSGIPRWNRTCY-AXUOBQJMSA-N 359.408 2.712 50 40 FFGB Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)C3CCC3)cc2)n1 22061079 BUUYAAQRTRQZFV-UHFFFAOYSA-N 370.478 2.947 50 40 FFGB CCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc(C)cc3C)ccc21 44820709 YGEWLNWQZMLBAM-UHFFFAOYSA-N 365.433 2.677 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)CCc2ccc(O)c(O)c2)cc1OC 5952144 CMMAVBHZCFEHIG-FYJGNVAPSA-N 372.421 2.978 50 40 FFGB COc1cc(/C=N/NC(=O)CNc2ccc(C)c(C)c2)ccc1OCC#N 409383620 YHZFDCBPHYDKGH-FSJBWODESA-N 366.421 2.777 50 40 FFGB C/C(=N\NC(=O)c1cc(O)c(O)c(O)c1)c1cccc(Br)c1 16102314 QMCFSNMYGFFYKG-CAOOACKPSA-N 365.183 2.720 50 40 FFGB O=C(O)c1ccccc1-c1ccc(/C=N/NC(=O)[C@@H](O)c2ccccc2)o1 409263449 MSUFPADKDGLMNZ-IUOVYFEOSA-N 364.357 2.829 50 40 FFGB O=C(COc1ccc2ccccc2c1)NNC(=O)c1cc(F)cc(F)c1 32845876 PJGRUBKRHKPMNE-UHFFFAOYSA-N 356.328 2.958 50 40 FFGB O=C(Cn1c(-c2ccccn2)nc2ccccc21)N/N=C/c1cccc(O)c1 226864652 DVWIQGZQPCEUAL-YDZHTSKRSA-N 371.400 2.954 50 40 FFGB CCC(/C=N\CCBr)(CCC(=O)OC)CCC(=O)OC 104150679 AETWPLXSXNYTRC-WJDWOHSUSA-N 350.253 2.755 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)COc2cc(C)ccc2C)c2ccccc21 14010378 OALFHXHHMZOUML-ZBJSNUHESA-N 351.406 2.569 50 40 FFGB C/C(=N\NC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccncc1 6780465 GJTWXTOCXLOGSN-YBFXNURJSA-N 350.338 2.534 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@@H]12)N/N=C1/C[C@H]2C=CC[C@H]12 39345216 GIRIUIXSQOYDQJ-YFXZPJHUSA-N 354.454 2.683 50 40 FFGB Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)C2 8336794 YHGXCENOKNCAEW-AWQFTUOYSA-N 352.394 2.678 50 40 FFGB COc1ccc(C(=O)NN)cc1OCc1ccc(Br)cc1 226328790 SIMOUTQTCHEQHB-UHFFFAOYSA-N 351.200 2.640 50 40 FFGB Cc1nc2ccccn2c1/C=C(\C#N)C(=O)Nc1ccc2c(c1)OCCO2 6549236 UDBUQSNYDFMVRL-GXDHUFHOSA-N 360.373 2.960 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1c1cc([N+](=O)[O-])cs1 2500606 PRJQAGYKKWMYQS-CYBMUJFWSA-N 367.342 2.981 50 40 FFGB COC(=O)COc1ccccc1/C=N/NC(=O)c1cc2ccccc2o1 693867 IOBQTRDSFSWRRZ-RGVLZGJSSA-N 352.346 2.749 50 40 FFGB Cc1ccc(N2C(=O)[C@@H](Cc3ccccc3)S/C2=C(/C#N)C(N)=O)cc1 934837 DTYCYFJWPQJJIS-XUMLYMLNSA-N 363.442 2.907 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)cc1 9232158 HEDBZMXRBIUMIT-SRZZPIQSSA-N 359.813 2.505 50 40 FFGB Cc1ccccc1C(=O)Nc1ccc(C(=O)NNC(=O)c2ccco2)cc1 4679818 WNOYIKDQOYRKRX-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB CCc1ccc(CN(C)CC(=O)NNC(=O)c2ccccc2Cl)cc1 15442587 FMWFETNLDPTGRF-UHFFFAOYSA-N 359.857 2.795 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)CCC(=O)c2cccs2)c1 8349152 AKPYDLUBXCJYBX-UHFFFAOYSA-N 360.435 2.554 50 40 FFGB Cc1ccc(C(=O)NNC(=O)COC(=O)/C=C/c2ccccc2Cl)cc1 6552653 IKNXUKLTNVUBNL-ZHACJKMWSA-N 372.808 2.666 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C/c2cccc(OC)c2O)c(OC)c1 408865616 DDJHXMVEBWUJNZ-OQLLNIDSSA-N 368.389 2.641 50 40 FFGB Cc1occc1C(=O)NNC(=O)c1cc(C2CC2)nn1-c1ccccc1 7783661 PSGYHPSFEDVOHQ-UHFFFAOYSA-N 350.378 2.726 50 40 FFGB COc1ccc(/C(C#N)=C/c2ccc(OCC(N)=O)c(OC)c2)cc1OC 408580206 BFESATWLHVCRQN-OVCLIPMQSA-N 368.389 2.641 50 40 FFGB CC[C@@H](C)n1c(SCC(=O)/C(C#N)=C(/C)N)nc2ccccc2c1=O 104829098 AMQDJPPGIRJHAF-QTQPHVRFSA-N 356.451 2.785 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1 5937937 CMOLCDHPLIJVGE-UHFFFAOYSA-N 370.405 2.687 50 40 FFGB COC(=O)/C(C#N)=C/c1c(Oc2ccc(F)cc2)nc2ccccn2c1=O 2421006 WTKCMYZIAFWTFX-ZRDIBKRKSA-N 365.320 2.706 50 40 FFGB Cc1ccc(C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1 3450527 VGWLQDORADYACY-UHFFFAOYSA-N 352.312 2.854 50 40 FFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1cc(Br)ccc1O 4263293 ATYFEPLGEPGMJO-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB COc1cccc(OCCCOc2c(/C=N/NC(N)=O)cccc2OC)c1 13942813 MTZMALUZBJUDQY-FYJGNVAPSA-N 373.409 2.554 50 40 FFGB COc1ccccc1NC(=O)N/N=C\c1ccc(N2CCOCC2)cc1 409092864 ZZFDQWQANBQCOE-ZHZULCJRSA-N 354.410 2.687 50 40 FFGB C=CCc1ccc(OCCOc2ccccc2/C=N/NC(N)=O)c(OC)c1 9425737 KELDOXSCHDMIMG-HYARGMPZSA-N 369.421 2.884 50 40 FFGB O=C(N/N=C/c1cccnc1)C1CCN(C(=O)c2ccccc2Cl)CC1 409005450 ITTAPUDJAXMSNI-LPYMAVHISA-N 370.840 2.738 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2cc(C)n(-c3ccccn3)c2C)c(C)o1 78585529 DRAVPEOPWSNCTN-UHFFFAOYSA-N 352.394 2.774 50 40 FFGB Cc1ccsc1/C=N/NC(=O)C(=O)Nc1ccc(Br)cc1 13923661 AUIQBDIQDUQRIZ-LZYBPNLTSA-N 366.240 2.908 50 40 FFGB COc1cc(/C=N/NC(=O)c2cccs2)cc(Cl)c1OCC(=O)O 14134810 LMUJSQYBFOXWDV-REZTVBANSA-N 368.798 2.637 50 40 FFGB O=C1Nc2c(Cl)cc(Cl)cc2/C1=N\NC(=O)c1ccccc1O 6513785 NCXBTSIJPFVFLE-UHFFFAOYSA-N 350.161 2.785 50 40 FFGB O=C(N/N=C\c1cc(O)ccc1Br)c1ccc2c(c1)OCO2 4672160 IEDXWWHJXDDUMF-IDUWFGFVSA-N 363.167 2.647 50 40 FFGB O=C(O)c1cc(C(=O)O)cc(-c2ccc(/C=N\NC(=O)c3ccco3)o2)c1 409063293 KCLIXCIWOVWHPV-OCKHKDLRSA-N 368.301 2.700 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2ccc(OC)cc2O)cc1OCC 409393714 ZEXQHALLZBNZOW-UDWIEESQSA-N 358.394 2.962 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2Cl)c1 408609207 JRNKJOGPTWZXBI-SRZZPIQSSA-N 359.813 2.505 50 40 FFGB O=C(N/N=C\c1cccc(F)c1)C(=O)Nc1cccc(C(F)(F)F)c1 223154718 GYEOGGBUATXHTG-NKVSQWTQSA-N 353.275 2.933 50 40 FFGB CCOc1cc(C(=O)N/N=C/c2cnn(CC)c2F)ccc1OC(F)F 252489155 JIHHKLZXHVKKGP-DNTJNYDQSA-N 370.331 2.806 50 40 FFGB Cc1ccc(S(=O)(=O)/C(C#N)=C\N2CCN(c3ccccc3)CC2)cc1 102820912 FIRFEZICMAFISK-SILNSSARSA-N 367.474 2.956 50 40 FFGB Cc1ccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)n2C)o1 2317588 LIZQDSZRFXCOIH-VCHYOVAHSA-N 355.423 2.626 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc(Cl)c1O 6684234 PGDBHXPFOCJNLM-UFWORHAWSA-N 362.769 2.937 50 40 FFGB Cc1cccc(NCC(=O)N/N=C2\C(=O)N(C(C)C)c3ccccc32)c1 5705378 PEDIKMVLMDITNL-NMWGTECJSA-N 350.422 2.682 50 40 FFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O)C(C)(C)C 408782514 HRDSKZVFSCIUBK-GZTJUZNOSA-N 359.879 2.644 50 40 FFGB N#CCC(=O)NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 408739519 XFXRWRWTFVPPFM-UHFFFAOYSA-N 369.293 2.659 50 40 FFGB CCOC(=O)c1[nH]c(C)c([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)c1C 1069934 AAPHPQOLGDSXAQ-OAHLLOKOSA-N 355.394 2.623 50 40 FFGB O=C(C[C@H]1C[C@H]2CC[C@@H]1C2)NNC(=O)c1cncn1-c1ccc(F)cc1 8294280 MNPYEKOXSVGOQB-BFHYXJOUSA-N 356.401 2.599 50 40 FFGB Cc1cc(C)nc(Sc2ccc(/C=C(\C#N)C(N)=O)cc2[N+](=O)[O-])n1 409149867 SUTXBXYFJYPNTJ-WUXMJOGZSA-N 355.379 2.545 50 40 FFGB CN(NC(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccccc1 45885907 WYQNRRYGRGQGHX-UHFFFAOYSA-N 358.341 2.761 50 40 FFGB COC(=O)c1ccc(C(=O)NNc2nc3ccc(OC)cc3s2)cc1 4121398 HBRNJTVFUZLVPQ-UHFFFAOYSA-N 357.391 2.848 50 40 FFGB COc1cccc(/C=N/NC(=O)c2c(C)nc3cc(C)ccn23)c1OC 59459791 GYPDNFKCNWTOMA-RGVLZGJSSA-N 352.394 2.732 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCC3)c2C)c(C)c1 58912472 PPXGYELYZFDGDT-LPYMAVHISA-N 366.465 2.783 50 40 FFGB C[C@@H](CC(=O)NNC(=O)c1cncn1-c1ccc(F)cc1)c1ccccc1 6173656 DKLUFVKGOGWLJY-AWEZNQCLSA-N 366.396 2.966 50 40 FFGB CCOc1ccc(/C=N\NC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OCC 408918577 MCRUVROMDMVJDR-ODLFYWEKSA-N 373.365 2.862 50 40 FFGB Cc1ccc(CC(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)c(C)c1 20194661 PFNDWMOCZYVPDF-DJKKODMXSA-N 355.350 2.633 50 40 FFGB CC(=O)Oc1ccc(/C=N/NC(=O)COc2cccc3cccnc23)cc1 408766494 UVQKBEGTUUCKED-WSDLNYQXSA-N 363.373 2.689 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc(-c3ccccc3)n[nH]2)c(OC)c1 4705517 UHBADTFMACJFIO-UDWIEESQSA-N 350.378 2.858 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN(c2cc(C)cc(C)c2)S(C)(=O)=O)cc1 408773262 JQUNSRYBHQZGHD-UDWIEESQSA-N 373.478 2.528 50 40 FFGB COc1cc(OC)c(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc1Cl 408586357 BLEKNTQMCDMMBM-UFWORHAWSA-N 362.769 2.850 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)c1cc(Cl)ccc1Cl 6584514 FBXPQHPUJGEDAR-UHFFFAOYSA-N 369.204 2.842 50 40 FFGB COC(=O)c1nc(-c2ccc(C)cc2)oc1NNC(=O)C(Cl)Cl 101427108 BUALVYLZZBUAPC-UHFFFAOYSA-N 358.181 2.683 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)N2CCCC2)cc(Br)c1OC 409372590 MZYWFLHXPKJZIA-KPKJPENVSA-N 365.227 2.996 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1 1079030 AZOJQVPYIKXQIN-MQMKENTISA-N 372.446 2.869 50 40 FFGB Nc1ccc(C(=O)NNC(=S)Nc2ccccc2C(F)(F)F)cc1 2388201 WADBHHUTENKQDD-UHFFFAOYSA-N 354.357 2.919 50 40 FFGB COC(=O)c1ccc(C(=O)NNc2nc3c(OC)cccc3s2)cc1 4121320 SXLUMNWVBIWHDI-UHFFFAOYSA-N 357.391 2.848 50 40 FFGB CCCCNC(=O)CSC1=C(C#N)[C@H](c2ccc(OC)cc2)CC(=O)N1 6323080 NFXMUQDEQXSSGL-HNNXBMFYSA-N 373.478 2.683 50 40 FFGB CC(C)C(=O)N/N=C\c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1 58883328 FDUGZUSJEKOIDB-NHDPSOOVSA-N 357.385 2.949 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 12362510 RMHBJVLVGABPPW-YBFXNURJSA-N 371.349 2.529 50 40 FFGB CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2OCC)cc1 7812310 OVMUTAFLNLNPQK-DEDYPNTBSA-N 355.394 2.573 50 40 FFGB C[C@@H]1S/C(=C(/C#N)C(=O)NCc2ccco2)N(c2ccc(F)cc2)C1=O 12579969 AUJJDEKTEYLISW-KLIGIEKFSA-N 371.393 2.939 50 40 FFGB N#C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc2c(c1)OCO2 59133341 FGALGUCXUSPOMK-VGOFMYFVSA-N 351.318 2.547 50 40 FFGB CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)CCl)c1 12504866 KBSQGGBPBXNYDC-UHFFFAOYSA-N 362.879 2.682 50 40 FFGB in-vitro Cc1cccc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)c1C 408905900 ASAWVCGBIWEFRS-UHFFFAOYSA-N 365.499 2.896 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1 5267868 HAQSLGNAVLULLI-UHFFFAOYSA-N 370.796 2.814 50 40 FFGB Cc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1cccc(N(C)C)c1 4748911 DGYPCCXRNOIPMD-PXLXIMEGSA-N 366.465 2.662 50 40 FFGB C#CCOc1c(Cl)cc(/C=N\NC(=O)c2cccnc2)cc1OCC 33876021 DIOOLPDVQISUNH-NHDPSOOVSA-N 357.797 2.910 50 40 FFGB N#CS[C@]1(CN2CCOCC2)COc2c(Cl)cc(Cl)cc2C1=O 19682199 QDDHLPXBXFPQJR-OAHLLOKOSA-N 373.261 2.854 50 40 FFGB N#CCC(=O)N/N=C\c1cn(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12 12363896 ULMCIEWUXCAABS-NHDPSOOVSA-N 361.361 2.962 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc(F)cc2)cc1 12539799 OIJISPYBXGFUCC-UHFFFAOYSA-N 368.368 2.689 50 40 FFGB COC(=O)c1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)N(C)C)c2C)c1 59333766 CDZHONQJMBCAMH-YVLHZVERSA-N 351.406 2.876 50 40 FFGB COc1ccc(N2N=C(C)/C(=C(\C)NNC(=O)c3cccs3)C2=O)cc1 103916736 ZASXBNNWWGUXPU-WJDWOHSUSA-N 370.434 2.688 50 40 FFGB N#C/C(=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)C(=O)Nc1ccccc1 408741516 JIHQQFSBFZSJPR-WDZFZDKYSA-N 354.278 2.754 50 40 FFGB CCN(CC)C(=O)/C(C#N)=C\c1ccc(O)c(I)c1 408904002 CDYQNRSYNKVBSC-XFFZJAGNSA-N 370.190 2.772 50 40 FFGB CCOc1ccc([C@H]2CC(=O)N3CN(C)CSC3=C2C#N)cc1OC 20238074 DPXAWTNSKFEZNM-CYBMUJFWSA-N 359.451 2.739 50 40 FFGB CCOc1ccc2[nH]c(=O)c(/C=N/NC(=O)c3ccc(OC)cc3)cc2c1 23190973 OLEULYDJZIPKCW-CIAFOILYSA-N 365.389 2.699 50 40 FFGB COc1cccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1O 4704996 RMDGBPMIINOFNM-GIJQJNRQSA-N 355.306 2.819 50 40 FFGB CCOc1cc2c(cc1/C=N\NC(=O)c1ccc(C)cc1OC)OCO2 409100229 VOSKWHOVYDNURL-JMIUGGIZSA-N 356.378 2.895 50 40 FFGB Cc1cc(C(=O)N/N=C(\CCC(=O)O)c2ccccc2)ccc1[N+](=O)[O-] 17073435 CCIJKOSAUPZXMF-XDJHFCHBSA-N 355.350 2.902 50 40 FFGB O=C(NNC(=O)c1ccccc1OC[C@H]1CCCO1)c1cccc(Cl)c1 32491510 KOGCXANGIMENQF-OAHLLOKOSA-N 374.824 2.973 50 40 FFGB C=C1CC(C(=O)N/N=C/c2ccc(OC)c(I)c2)C1 6457875 YSEWDCQWTJCHBT-LZYBPNLTSA-N 370.190 2.716 50 40 FFGB CNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(N3CCOCC3)cc2)c1C 824405 DGVQVJPHCBMCKV-QGOAFFKASA-N 364.449 2.584 50 40 FFGB Cc1ccc(C(=O)NNc2ncnc3c2cnn3Cc2ccccc2)cc1 1240115 PAVMDORNNSNMPE-UHFFFAOYSA-N 358.405 2.940 50 40 FFGB Cc1nc2ccccc2n1CC(=O)NNC(=O)CCCc1cccs1 32845126 SDZVEUIIPYCJAR-UHFFFAOYSA-N 356.451 2.577 50 40 FFGB COc1ccc(Br)cc1/C=N/NC(=O)COc1ccccc1 3167234 JQXCHDKRCMRQLA-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB COc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1ccc(N(C)C)cc1 5333999 RHFHHGLPFMDMHQ-RGVLZGJSSA-N 374.828 2.503 50 40 FFGB CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)NCCc2ccccc2)cc1 5379879 TZSAWMNUQRTWGQ-HZHRSRAPSA-N 351.450 2.793 50 40 FFGB COc1cc(Br)cc(/C=N/NC(=O)c2ccc(C)nc2)c1O 880795 SJGUVWAVIWBPLN-QGMBQPNBSA-N 364.199 2.631 50 40 FFGB Cc1cccc(C(=O)Nc2ccccc2C(=O)NNC(=O)c2ccco2)c1 17255493 DKLPCUNNYIOVFZ-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB N#CCC(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 28214285 ZVQSQEDQGSCTEF-SRZZPIQSSA-N 370.796 2.721 50 40 FFGB CC(C)(C)c1ccc(OCC(=O)N/N=C2\N=C(N)c3ccccc32)cc1 16323227 QPACRCABIWPZIG-UHFFFAOYSA-N 350.422 2.560 50 40 FFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1 408748195 ZVRRONDGBXCQNW-PDGQHHTCSA-N 364.401 2.852 50 40 FFGB N#Cc1ccc(C(=O)N/N=C/c2cc(Br)ccc2O)c(F)c1 408965786 IOCMZQAXQFCMDH-UFWORHAWSA-N 362.158 2.929 50 40 FFGB C/C(CC(=O)Nc1ccccc1C(F)(F)F)=N\NC(=O)c1cnccn1 14920329 SFRAMMHEJHOTTR-AUEPDCJTSA-N 365.315 2.630 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(O)cc2O)cc1C 6215655 UUXWFWDGRFBNPZ-RGVLZGJSSA-N 355.394 2.584 50 40 FFGB C=CCNC(=O)/C(C#N)=C/c1ccc(OC(=O)c2ccco2)c(OC)c1 1786078 FVRMQXFVXLTNPZ-GXDHUFHOSA-N 352.346 2.717 50 40 FFGB CC1(C)Cc2cccc(OCC(=O)NNC(=O)c3cccc(Cl)c3)c2O1 2645764 CAIKELYZPVJROW-UHFFFAOYSA-N 374.824 2.894 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc(F)cc2)ccc1OCC(=O)OC 8812392 GQLALTWXTUFZNJ-SRZZPIQSSA-N 374.368 2.540 50 40 FFGB Cc1cccc(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)c1 8474823 CNZKMXHHLBQMEK-JAYDOHCTSA-N 350.212 2.505 50 40 FFGB COc1cc(C)ccc1C(=O)NNC(=S)NCCCc1ccccc1 408585599 GXALZVSUCXQFRR-UHFFFAOYSA-N 357.479 2.745 50 40 FFGB C[C@@](O)(CBr)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 34211566 JSZFXNCCDXABCT-LLVKDONJSA-N 351.122 2.661 50 40 FFGB in-vitro O=C(NNC(=O)c1cccc(Cl)c1)c1ccc(OC[C@H]2CCCO2)cc1 2645781 PMKALYYIASKDJU-QGZVFWFLSA-N 374.824 2.973 50 40 FFGB O=[N+]([O-])c1ccc([C@H]2[C@H]3C[C@H]4[C@H](OO[C@@H]42)[C@@H]3I)cc1 104068055 OPAZSUHPECXLGD-QKFSQAGISA-N 373.146 2.831 50 40 FFGB COc1ccc(CC(=O)N/N=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1OC 4735399 UHPJVTIUTMMICT-YQJIRVCQSA-N 369.377 2.970 50 40 FFGB O=C(Cc1ccc(F)cc1)NNS(=O)(=O)c1ccc2ccccc2c1 7387992 FNQWFYDVLZJZNR-UHFFFAOYSA-N 358.394 2.531 50 40 FFGB O=C(O)c1ccc(-c2ccc(/C=N/NC(=O)[C@@H](O)c3ccccc3)o2)cc1 409265617 UEHMBBAGDNINHG-IUOVYFEOSA-N 364.357 2.829 50 40 FFGB O=C(O)c1ccc(-c2ccc(/C=N/NC(=O)[C@H](O)c3ccccc3)o2)cc1 409265616 UEHMBBAGDNINHG-AGKWGAAGSA-N 364.357 2.829 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)Cc1ccc(C)cc1C 216039118 IMJQQOLYTSDXPM-BKUYFWCQSA-N 365.389 2.916 50 40 FFGB CC[C@H](Br)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 61487925 RSLGQRKMKXCTMT-LBPRGKRZSA-N 352.232 2.596 50 40 FFGB COc1ccc(S(=O)(=O)/N=C(O)/C(C#N)=C\c2ccco2)c(OC)c1 48611630 IWIDQNUGYCYDCS-FLIBITNWSA-N 362.363 2.549 50 40 FFGB Cc1nc(COc2cccc(C(=O)NNC(=O)c3ccco3)c2)cs1 16228584 NFVXDYJFSBLFQJ-UHFFFAOYSA-N 357.391 2.698 50 40 FFGB Cc1cccc(C)c1NC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br 408682695 GPWNQOITJRBOCC-LREAXHOUSA-N 364.239 2.813 50 40 FFGB Cc1cc(/C=N\NC(=O)COc2cccc(Br)c2)c(C)n1C 408781175 BECZAEWZZJXVFR-NVMNQCDNSA-N 364.243 2.934 50 40 FFGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)c1ccccc1-n1cccc1 32704953 AOEQJCLFAWMUPL-UNOMPAQXSA-N 350.334 2.855 50 40 FFGB O=C=Nc1ccc(OC(=O)CCC(=O)Oc2ccc(N=C=O)cc2)cc1 209429038 ATUMZLIWIUHCGY-UHFFFAOYSA-N 352.302 2.912 50 40 FFGB C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@]3(C(=O)Nc4ccccc43)[C@H]2C1 4115158 SLCAPPSOGCMOQX-PTPDTQQLSA-N 355.401 2.633 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc(OC)c(OC)c2)cc1 102735977 DZRNWMFQUZQCLP-VBKFSLOCSA-N 374.418 2.963 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3cc(OC)c(OC)cc3[nH]2)cc1 2404564 FAPVITOQIDPXAA-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB Cc1cc(C)c(CNC(=O)NNc2ccccc2C(F)(F)F)c(=O)[nH]1 95351159 ZBQPYTPVQHVSSI-UHFFFAOYSA-N 354.332 2.837 50 40 FFGB O=C(N/N=C\c1cccc([N+](=O)[O-])c1OC(=O)c1ccco1)c1ccco1 409225854 RIEPXZKWFNHNJW-ZDLGFXPLSA-N 369.289 2.764 50 40 FFGB CCOc1ccccc1NC(=O)C(=O)N/N=C\c1c(F)cccc1Cl 210956513 JVRVEZUKHASRCY-JMIUGGIZSA-N 363.776 2.967 50 40 FFGB O=C(CCCC[C@H]1CCSS1)N[C@H]1CCc2nnc(O)cc2C1 575610017 NNGHDYRYCZUFIQ-STQMWFEESA-N 353.513 2.870 50 40 FFGB Cc1cc(OCC(=O)NNC(=O)CCOc2ccccc2)ccc1Cl 1808102 WJRGIHBGLMYZTO-UHFFFAOYSA-N 362.813 2.644 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2)cc1 7869269 XROGPRGXMQBBBB-LPYMAVHISA-N 373.840 2.895 50 40 FFGB Cc1nn(-c2cccc(O)c2)c2c1[C@@H](c1cccc(O)c1)C(C#N)=C(N)O2 59416588 BPDOZNUTORDFOL-SFHVURJKSA-N 360.373 2.810 50 40 FFGB C/C(=N/NC(=O)CNC(=O)COc1cccc(C)c1)c1ccc(Cl)cc1 5033714 QBXOUMPLCOOHHP-HMAPJEAMSA-N 373.840 2.684 50 40 FFGB O=[N+]([O-])C1=C([N+](=O)[O-])[C@H](S[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2Br)C=C1 5031483 HSONDIAAORAILM-WCRAGTEESA-N 361.217 2.985 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)Cc1ccc(C)cc1 409363566 UOLZPWLRWGOCRF-MOSHPQCFSA-N 351.362 2.608 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@@H]12)N/N=C1/C[C@@H]2C=CC[C@H]12 138821971 GIRIUIXSQOYDQJ-GEPZRPMMSA-N 354.454 2.683 50 40 FFGB C=CCOc1c(Br)cc(/C=C(\C#N)C(N)=O)cc1OCC 7154624 WJPBRHYHRUPDLV-IZZDOVSWSA-N 351.200 2.805 50 40 FFGB CN(C)N(C(=O)c1cccc(Oc2ccccc2)c1)[C@@H]1CCS(=O)(=O)C1 5298364 JWHNBLNIKYBPPK-MRXNPFEDSA-N 374.462 2.585 50 40 FFGB Cc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)c2ccco2)cc1 409001141 HGRIQYZVPDSZMI-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB CCCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccncc2)s1 33722244 BDVOHOLJYQPHHI-XDHOZWIPSA-N 374.470 2.535 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(N3CCOCC3)cc2C)cc1 409098800 LZZJILBQKMRHRN-KGENOOAVSA-N 353.422 2.604 50 40 FFGB O=C(CNC(=O)c1cccs1)N/N=C/c1ccc(C(F)(F)F)cc1 4086449 LAXGKSSHGICEDV-DNTJNYDQSA-N 355.341 2.647 50 40 FFGB Cc1cc2c(c(=O)n1Cc1ccccc1)[C@@H](c1cccnc1)C(C#N)=C(N)O2 1471899 NPWHBLHLFCMJHX-IBGZPJMESA-N 370.412 2.818 50 40 FFGB COC(=O)Cc1[nH]nc2c1[C@H](c1ccc(C(C)(C)C)cc1)C(C#N)=C(N)O2 803865 JLIINJWUYXUEQI-MRXNPFEDSA-N 366.421 2.641 50 40 FFGB N#CC1=C(SCC(=O)N2CCCC2)NC(=O)C[C@H]1c1ccc(F)cc1 6495381 AZDDTGAPWBYOAY-AWEZNQCLSA-N 359.426 2.520 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1cccc([N+](=O)[O-])c1 8017754 XXYJOGOQCQQVTQ-HNNXBMFYSA-N 360.329 2.654 50 40 FFGB CCSc1ncc(Cl)c(C(=O)NNC(=O)c2ccccc2C)n1 27995626 CTTZBHNVPIBMDU-UHFFFAOYSA-N 350.831 2.625 50 40 FFGB Cn1cc(C(=O)NNC(=O)N[C@H]2CCOc3ccccc32)c2ccccc21 45116275 XYZQZFYRLSUYFI-INIZCTEOSA-N 364.405 2.646 50 40 FFGB CC[C@H](C)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 12919096 XBLGFJSHOKSKCS-AWEZNQCLSA-N 363.421 2.741 50 40 FFGB O=C(NNC(=O)c1nn(-c2ccccc2)c2c1CCC2)c1ccccc1F 8745885 FOJZPHUHWYDBNI-UHFFFAOYSA-N 364.380 2.575 50 40 FFGB Cc1ccc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)cc1C 20208688 CUTWGEZCLYSAOZ-UHFFFAOYSA-N 365.499 2.896 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)CNc2ccc(F)cc2)cc1[N+](=O)[O-] 409362881 HDLWIUPKOUWISV-RGVLZGJSSA-N 360.345 2.695 50 40 FFGB CCS(=O)(=O)[C@@H](I)[C@@H](O)c1ccc(Cl)cc1 96519255 ZHTHAKSDTTVRCG-VHSXEESVSA-N 374.627 2.569 50 40 FFGB COc1ccc([C@H](C)NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2)cc1 2055061 JWAPFZCXSDKTDG-DQAKUKQTSA-N 359.813 2.676 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cc1 3362893 GNYQECOGNLJILV-GOSISDBHSA-N 354.406 2.628 50 40 FFGB O=C(CCCc1ccc2c(c1)-c1ccccc1C2)NNC(=O)[C@@H]1CCCO1 64488572 CFPQJWNVRFRICO-FQEVSTJZSA-N 364.445 2.907 50 40 FFGB Cc1cccc(C)c1OCC(=O)NNC(=O)c1cc(Cl)ccc1F 7960722 PDWQTWQHVOUXJQ-UHFFFAOYSA-N 350.777 2.936 50 40 FFGB C/C(=N\NC(=O)COc1cc(C)ccc1C)c1ccc2c(c1)OCCO2 5362757 UYXSJZPULFTLJB-RCCKNPSSSA-N 354.406 2.994 50 40 FFGB O=C(N/N=C/c1cccc(F)c1)c1c(O)c2cc(Cl)ccc2[nH]c1=O 5446481 JPSCRSJLVGDWPC-DNTJNYDQSA-N 359.744 2.790 50 40 FFGB COc1cc(/C=N\NC(=O)c2ccc(C)nc2)cc(Br)c1O 30732617 DVITVHBXSYRAKR-WSVATBPTSA-N 364.199 2.631 50 40 FFGB CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(C)=C(C)C[C@@H]2C(=O)O)cc1 2797214 NQQSZLWXQJHCBC-SJORKVTESA-N 374.437 2.684 50 40 FFGB Cc1ccc(O[C@H](C)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1 7990086 FOJJAZMNJJNYGC-MRXNPFEDSA-N 356.422 2.606 50 40 FFGB C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/C1=Cc2ccccc2O[C@H]1C 2373827 MVRQREBAXNWAMR-QFRBTTLPSA-N 359.426 2.866 50 40 FFGB CC(=O)Oc1ccccc1C(=O)[C@H](Br)CBr 309325649 QTKUYINVVVRXAG-SECBINFHSA-N 350.006 2.953 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(F)cc2)c1 408609185 JOZKVWGFIKFTEH-LVCXCXRVSA-N 371.412 2.770 50 40 FFGB O=C(N[C@@]1(C(Cl)Cl)NC(c2cccs2)=NC1=O)c1ccccc1 97977258 VMMVQSDIMBIJHW-OAHLLOKOSA-N 368.245 2.555 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)c(OC)c1 13338269 RJDCUKBFSRNYHY-NTEUORMPSA-N 352.346 2.948 50 40 FFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccccc2O)c2ccccc21 14134737 DOGSCUDSXUVISM-SRZZPIQSSA-N 365.389 2.674 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1ccc(O)c(O)c1)CO2 31849126 PAVGBADMXKMVEC-BYSCUOHCSA-N 370.405 2.685 50 40 FFGB CCCC1=C(C(=O)OCC)[C@]2(C(=O)Nc3ccc(C)cc32)C(C#N)=C(N)O1 850922 AZQOIZUBXQBDLC-HXUWFJFHSA-N 367.405 2.526 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@@H](NC(=O)Cc1cccs1)C(C)C 2057436 ZSCWRUPPVWQKHT-TYJAPOHBSA-N 373.478 2.590 50 40 FFGB CC/C(CNC(=O)c1ccccc1)=N\NC(=O)CN(CC)c1ccccc1 5231263 ILVGLMIUTVGHTJ-PTGBLXJZSA-N 366.465 2.825 50 40 FFGB CC[C@@H](Oc1ccccc1)C(=O)NNC(=O)COc1cc(C)ccc1C 6541402 PRRUVZMKIWGAHU-QGZVFWFLSA-N 356.422 2.687 50 40 FFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O)C(C)(C)C 408786164 FZWRFNMJGGJEFT-LDADJPATSA-N 373.906 2.953 50 40 FFGB CC(C)NC(=O)COc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1 409116504 VIQFJDWUQUDDCL-HYARGMPZSA-N 367.449 2.673 50 40 FFGB Cc1cc(C)cc(OCC(=O)n2c(C)c(C(=O)NN)c3ccccc32)c1 218738885 SRFZPVPRZUTUQR-UHFFFAOYSA-N 351.406 2.889 50 40 FFGB O=C(CN1CCOCC1)N/N=C\c1cc(/N=N/c2ccccc2)ccc1O 59246387 GANTYBPLLBJIIT-AUOXKNKGSA-N 367.409 2.590 50 40 FFGB C/C(CC(=O)Nc1ccc([N+](=O)[O-])cc1)=N/NC(=O)C1[C@H]2CCCC[C@H]12 100505500 IVOGQQSWWHBBJF-XZJJPRJLSA-N 358.398 2.852 50 40 FFGB N#C/C(=C\c1ccc(O)c(I)c1)C(=O)N1CCCC1 409367735 JWLVEPNWPHOJDP-YRNVUSSQSA-N 368.174 2.526 50 40 FFGB N#C/C(=C/c1cn(CC(=O)O)c2ccccc12)C(=O)NCc1ccccc1 13126045 NCHHUUVWLNYFHK-YBEGLDIGSA-N 359.385 2.949 50 40 FFGB Cn1c(=O)c2c(c3ccccc31)OC(N)=C(C#N)[C@H]2c1ccccc1[N+](=O)[O-] 20086115 HAJAFYZCBMGUKD-MRXNPFEDSA-N 374.356 2.665 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2cccc(C)c2O)cc1 4697760 KMPUIRYUABYEHO-HYARGMPZSA-N 369.421 2.521 50 40 FFGB Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NNC(=O)c1ccccc1 12753058 QPEVHGNSNAYTKG-UHFFFAOYSA-N 352.369 2.703 50 40 FFGB Cc1cccc2c(=O)n(CCCC(=O)NN(C)c3ccccc3)cnc12 10233960 SKURUUFAEHMPSO-UHFFFAOYSA-N 350.422 2.653 50 40 FFGB COc1ccc(OCC(=O)N/N=C\c2cn(CC#N)c3ccccc23)cc1 409379298 VVABDCBEXIOBKY-UUYOSTAYSA-N 362.389 2.703 50 40 FFGB COc1ccc(Cn2c(=O)c3ccccc3n3c(CCl)nnc23)cc1 408712785 QTZUIXZIKGENDI-UHFFFAOYSA-N 354.797 2.840 50 40 FFGB CCCc1n[nH]c2c1[C@H](c1cc3c(cc1Cl)OCO3)C(C#N)=C(N)O2 18115860 ORFURBLKFICVRL-CQSZACIVSA-N 358.785 2.962 50 40 FFGB O=C(O)c1ccccc1-c1ccc(/C=N/NC(=O)[C@H](O)c2ccccc2)o1 409263444 MSUFPADKDGLMNZ-AGKWGAAGSA-N 364.357 2.829 50 40 FFGB COc1cc2c(cc1/C=N\NC(=O)CNc1ccc(C)c(C)c1)OCO2 409065231 IIDLIZDRMNZYQS-NKVSQWTQSA-N 355.394 2.603 50 40 FFGB COC(=O)c1ccc(/C=N\NC(=O)CSc2nc3ccccc3o2)cc1 32519970 UZJHJDIKGPCPIZ-GRSHGNNSSA-N 369.402 2.857 50 40 FFGB CCO[C@H](C)n1nccc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402637 OMWSKAYNKKXXGQ-BDJLRTHQSA-N 356.426 2.889 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)/C=C/c2ccc(Cl)cc2)c1 6236850 NWSKNGIWWIJPIH-VMPITWQZSA-N 360.797 2.832 50 40 FFGB Cc1c(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc2n1C 711767 NABMDQDAWPYUPV-RGVLZGJSSA-N 366.377 2.924 50 40 FFGB C/C(CC(=O)NC12CC3CC(CC(C3)C1)C2)=N\NC(=O)c1ccccc1O 100089513 NWHNFJGCMWGTPH-YDZHTSKRSA-N 369.465 2.973 50 40 FFGB CCCNC(=O)CSC1=C(C#N)[C@H](c2ccc(OCC)cc2)CC(=O)N1 6879719 XYJYQGUXSBFJRA-HNNXBMFYSA-N 373.478 2.683 50 40 FFGB CCc1cccc2c1NC(=O)/C2=N\NC(=O)c1nc2ccccc2s1 12602227 QMHFGABSROBRLR-UHFFFAOYSA-N 350.403 2.945 50 40 FFGB O=C(O)[C@@H](Br)[C@H](Br)c1cccc([N+](=O)[O-])c1 6220973 AYUJMWVMPDGXFF-SFYZADRCSA-N 352.966 2.879 50 40 FFGB Cc1ccc(C)c(N(CC(=O)NN=C2CCCCC2)S(C)(=O)=O)c1 408784777 UYEASCQINRKFFZ-UHFFFAOYSA-N 351.472 2.506 50 40 FFGB Cc1cc([N+](=O)[O-])cc2c1NC(=O)/C2=N\NC(=O)c1ccc(Cl)cc1 15015429 LYUMCJHYAVXQMQ-UHFFFAOYSA-N 358.741 2.643 50 40 FFGB Cc1c(-c2ccccc2)oc2c(C(=O)NNC(=O)C3CC3)cccc2c1=O 26966569 WUODBXKGVKZYQC-UHFFFAOYSA-N 362.385 2.939 50 40 FFGB C#CCOc1ccc(OC)cc1/C=N/NC(=O)c1ccc(OCC)cc1 20763783 DIJLOLHGIVKZGW-KGENOOAVSA-N 352.390 2.870 50 40 FFGB Cc1cccc(C)c1OCC(=O)n1c(C)c(C(=O)NN)c2ccccc21 218737657 IOFXUPDNASXPGU-UHFFFAOYSA-N 351.406 2.889 50 40 FFGB O=C(CN1C[C@H](c2ccccc2)CC1=O)N/N=C/c1ccc(Cl)cc1 5901681 PGVGDPAUJMPVLB-BTZNOAQDSA-N 355.825 2.806 50 40 FFGB Cc1occc1C(=O)N/N=C/c1cc2c(cc1Br)OCO2 2737007 FJTUPISLFUOYEC-OMCISZLKSA-N 351.156 2.843 50 40 FFGB CC1=C(C#N)C(=O)N(C[C@@H]2CCCO2)C(=O)/C1=C\Nc1ccccc1F 9050846 FGONVYMAJALKKX-OJNRTJSBSA-N 355.369 2.509 50 40 FFGB Cn1cccc1C(=O)NNS(=O)(=O)c1ccc(C2CCCCC2)cc1 21632959 TZOCBEKMBBOVKE-UHFFFAOYSA-N 361.467 2.696 50 40 FFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(C)c([N+](=O)[O-])c1 409258538 XIMAJNXPZFARNQ-RQZCQDPDSA-N 358.310 2.584 50 40 FFGB CC(=O)[C@H]1N(S(=O)(=O)c2ccc(C)cc2)C([C@@H](C)Cl)=NC1(C)C 24718450 VLPKNRYRNYLHDY-BXUZGUMPSA-N 356.875 2.761 50 40 FFGB biogenic CC(C)(C)OC(=O)N1CC2(CC[C@H](CI)O2)C1 307718805 LYGQZEWJUKSMPU-SECBINFHSA-N 353.200 2.590 50 40 FFGB CCc1cc2c(=O)n(CC(=O)N/N=C\c3cccc(Cl)c3)cnc2s1 31783504 SNNKHZBJMOHWTL-ZBKNUEDVSA-N 374.853 2.824 50 40 FFGB CCS(=O)(=O)[C@H](I)[C@@H](O)c1ccc(Cl)cc1 96519254 ZHTHAKSDTTVRCG-UWVGGRQHSA-N 374.627 2.569 50 40 FFGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(OC)c(OC)c2)cc1 5416936 FHHXILOZBSQGDH-UDWIEESQSA-N 355.394 2.816 50 40 FFGB CC(=O)c1c[nH]c(C(=O)OCC(=O)N/N=C2/C[C@H]3CC[C@@]2(C)C3(C)C)c1 102874674 IYMGSCJHXCDZEI-WBCZHYMISA-N 359.426 2.693 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)COc2ccccc2C(C)C)c1 6523178 KMUXRSCOIISUSM-UHFFFAOYSA-N 356.422 2.724 50 40 FFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccccc3)CC2=O)cc1 6962992 OSXCZSSANVCLIM-REIAIGDLSA-N 351.406 2.589 50 40 FFGB CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2ccccc2C(=O)OC)C1=O 9421891 ITPAREVYHFKBMX-IEMQHYRPSA-N 367.405 2.776 50 40 FFGB CCOc1cc2c(cc1/C=C/C(=O)NNC(=O)c1ccoc1C)O[C@@H](C)C2 70019280 YGVHEGAVAGLIGB-FYJFLYSWSA-N 370.405 2.785 50 40 FFGB C[C@]12CC[C@@H]3[C@@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1C[C@@H](O)[C@]2(O)C#N 70669930 VZFYGLAXUCFBQI-HOCIQAIMSA-N 373.493 2.918 50 40 FFGB biogenic Cc1cccc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1 102607694 CNZKMXHHLBQMEK-WCQYUDONSA-N 350.212 2.505 50 40 FFGB COc1ccccc1NCC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 8747022 XBSZCOXGSZOGKS-UHFFFAOYSA-N 355.438 2.866 50 40 FFGB CCOc1cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])ccc1OC 4721088 YOBXTCLAGIDMAL-YBFXNURJSA-N 373.365 2.531 50 40 FFGB CC1(C)CC(=O)C2=C(C1)OC(C#N)=C(N)[C@@]21C(=O)Nc2ccc(Cl)cc21 585145621 GEKGDFRKZSNIPJ-IBGZPJMESA-N 369.808 2.897 50 40 FFGB C[C@H](OCC(F)(F)F)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 42819277 QTNNQSHXUKLIJR-HXTFMFRQSA-N 362.392 2.708 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)cc1 3168497 WRKFSZLUDYDLMI-KEBDBYFISA-N 373.796 2.524 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1ccccc1Br 5361954 WUWXYQBJZZEKHG-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1 3616586 YDKUVOCAMAHXPL-XNTDXEJSSA-N 350.330 2.717 50 40 FFGB C[C@@H]1C=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3)[C@]2(C)CN1C 20792420 MNEKLXLKKDRVIN-CFSSXQINSA-N 361.424 2.959 50 40 FFGB C[C@H]1CCc2c(C(=O)NNC(=O)[C@H]3CCCC[C@@H]3C(=O)O)csc2C1 6469142 CLIRJPAMEQUPHQ-DRZSPHRISA-N 364.467 2.525 50 40 FFGB COc1ccc(C)cc1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C 12763068 TWASIHRAISRTFB-MRXNPFEDSA-N 370.449 2.778 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc3c(c2)OCCO3)cc(Cl)c1O 2294417 NVIPUSLSPXOIEV-DJKKODMXSA-N 362.769 2.589 50 40 FFGB O=C(NCCCN1CCOCC1)[C@H]1Cc2ccccc2[C@@H]1C(Cl)Cl 95677009 HCDPYHLDBBGAFP-HOTGVXAUSA-N 371.308 2.585 50 40 FFGB COc1cc(C(=O)NN=Cc2c[nH]c3ccccc23)cc(OC)c1OC 16701331 VHTOJACGUMRGKR-UHFFFAOYSA-N 353.378 2.958 50 40 FFGB COC(=O)c1ccc([C@@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC(C)C)cc1 808926 CJDWCABBJHXZRG-MRXNPFEDSA-N 356.378 2.506 50 40 FFGB O=C(N/N=C/c1ccc2c(c1)OCCO2)c1cc2cc([N+](=O)[O-])ccc2o1 1106772 IRCILNNLDGXEGM-VXLYETTFSA-N 367.317 2.876 50 40 FFGB COc1ccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 408833883 ZXJXZTMLGBWLIX-RQZCQDPDSA-N 358.310 2.584 50 40 FFGB COc1ccc(OCC(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)cc1 6684581 PIVYHQBMAFMIIM-DEDYPNTBSA-N 358.394 2.632 50 40 FFGB COc1cc(Br)c(/C=C(\C#N)c2n[nH]c(N)c2C#N)cc1OC 4067318 FWIQCTDREHWJAC-YCRREMRBSA-N 374.198 2.707 50 40 FFGB C#CCOc1c(Cl)cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1OC 5045016 SAAUQVSTVHVIQB-HNNXBMFYSA-N 370.796 2.610 50 40 FFGB CNC(=O)/C(C#N)=C/c1c(Oc2cccc(C)c2C)nc2ccccn2c1=O 4205505 AWISKUGLMAVUQZ-RVDMUPIBSA-N 374.400 2.757 50 40 FFGB COC(=O)c1ccccc1N/C(SC)=C(/C#N)C(=O)N1CCCCC1 67172693 FERVQPYXISAFOM-JQIJEIRASA-N 359.451 2.996 50 40 FFGB CNC(=O)/C(C#N)=C\c1cccc(OC)c1OCc1ccc([N+](=O)[O-])cc1 409077442 DXLXPUCRVJTMSO-GDNBJRDFSA-N 367.361 2.835 50 40 FFGB CC(=O)N/N=C\c1ccccc1OCCOCCOc1ccc(C)cc1 4499587 SPKKZZMGSCAASO-QNGOZBTKSA-N 356.422 2.939 50 40 FFGB O=C(NNC(=O)[C@@H](Oc1ccccc1)c1ccccc1)C(Cl)Cl 1718090 NMKLUIWWTBULQP-ZDUSSCGKSA-N 353.205 2.758 50 40 FFGB COC(=O)CSC1=C(C#N)[C@H](c2ccc(OC)c(Cl)c2)CC(=O)N1 6441636 ALJSYLGIRMAMIK-JTQLQIEISA-N 366.826 2.593 50 40 FFGB Cc1nc2c(cc(OCC(=O)NNC(=O)C3CC3)c3ccsc32)s1 43112594 NWCNPYJTKDHLJH-UHFFFAOYSA-N 361.448 2.756 50 40 FFGB O=C(O)c1ccc(/C=N/NC(=O)c2cc(Br)ccc2O)cc1 59501728 SPAFPWSNENSQSS-CAOOACKPSA-N 363.167 2.617 50 40 FFGB Cc1cc(C)nc(NNC(=O)c2c(C)nn(-c3ccc(F)cc3)c2C)n1 12999189 RKCYQILJSKPXRD-UHFFFAOYSA-N 354.389 2.792 50 40 FFGB C/C(=N\NC(=O)c1c(C)nc2ccccn12)c1ccc2c(c1)OCCO2 5071016 PKFXZADAHKXYQX-CIAFOILYSA-N 350.378 2.568 50 40 FFGB CCOc1ccc(C(=O)N/N=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 20764097 UILYTTVFEMMMLW-YBFXNURJSA-N 373.365 2.775 50 40 FFGB CC1=C/C(=N\NC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1 5163522 ZEFOIOWUTXCXID-MNDPQUGUSA-N 361.467 2.687 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 722521 OKGBTTYBCPKWES-UHFFFAOYSA-N 356.422 2.833 50 40 FFGB O=C(NNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cc(-c2ccccc2)on1 12628824 SAIFJBWSONSVOW-UHFFFAOYSA-N 373.372 2.807 50 40 FFGB Cc1cc(C)cc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1 102612209 DRFLLNFZSRTEEU-LACSLYJWSA-N 364.239 2.813 50 40 FFGB O=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)c1ccccc1 2617909 JMUAKEHQYIGACC-UHFFFAOYSA-N 374.396 2.758 50 40 FFGB CCS(=O)(=O)[C@H](I)[C@@H](O)c1cccc(Cl)c1 96519238 KAADRHASOWQEQP-UWVGGRQHSA-N 374.627 2.569 50 40 FFGB Cc1ccc(/C=N/NC(=O)c2ccn(Cc3ccc([N+](=O)[O-])cc3)n2)o1 1089343 PLSUBKIVVWFWQB-VCHYOVAHSA-N 353.338 2.505 50 40 FFGB CC(C)c1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1 6307382 DYSWNFLZBPGNDV-DEDYPNTBSA-N 373.478 2.581 50 40 FFGB CC1(C)C/C(=N/NC(=O)c2cccc([N+](=O)[O-])c2)c2sc(N)nc2C1 5303371 WZIJMKCCZDHRIG-UNOMPAQXSA-N 359.411 2.740 50 40 FFGB O=C(N/N=C/c1ccc(O)cc1)c1cccc(I)c1 59513980 OVLZYVNHKIOVSN-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB NC(=O)N/N=C/c1ccc(OC(=O)c2ccc(Br)cc2)cc1 59399041 VAHURYMFMNKOBV-GIJQJNRQSA-N 362.183 2.671 50 40 FFGB Cc1cccc(O[C@@H](C)C(=O)NNc2ncc(Br)cn2)c1C 11914470 HIILMSTYOISPMP-NSHDSACASA-N 365.231 2.767 50 40 FFGB CCOc1cc(Cl)c(Cl)c(/C=N/NC(=O)c2cc(C)n[nH]2)c1O 5489090 JMSZOGPGVGNGLT-UBKPWBPPSA-N 357.197 2.893 50 40 FFGB Cc1nn([C@@H](C)C(=O)N/N=C/c2ccc(F)s2)cc1Br 252494778 OENRODRGPAADOY-PDMWYYABSA-N 359.224 2.866 50 40 FFGB N[C@H](CSCc1ccc(N(CCCl)CCCl)cc1)C(=O)O 1688235 JBBJXJJIYKNJFV-CYBMUJFWSA-N 351.299 2.616 50 40 FFGB CCOc1c(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cccc1OC 6595464 YLRCMTFSOYONAG-UDWIEESQSA-N 355.394 2.816 50 40 FFGB O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O 1424008 JRILKNBHROGBNR-UHFFFAOYSA-N 370.148 2.682 50 40 FFGB O=C(Cc1csc(-c2ccccc2Cl)n1)NNC(=O)c1cccnc1 13001455 CHCGJZBCAJTBCE-UHFFFAOYSA-N 372.837 2.862 50 40 FFGB O=C(N/N=C/c1cccc2c1OCCO2)c1ccc(Cl)c([N+](=O)[O-])c1 408829983 MSWRMUJAUMPNRB-GIJQJNRQSA-N 361.741 2.783 50 40 FFGB COc1cc(/C=C(\C#N)C(N)=O)c([N+](=O)[O-])cc1OCc1ccccc1 17699937 QAPTZOLJARMXAF-VGOFMYFVSA-N 353.334 2.575 50 40 FFGB C[C@H](C(=O)C(C#N)=C1Nc2ccccc2N1)N1C(=O)c2ccccc2C1=O 5595718 XKGLLASWZOPLIJ-LLVKDONJSA-N 358.357 2.513 50 40 FFGB CCOC(=O)/C(C#N)=C/c1ccc(OS(=O)(=O)c2ccccc2)cc1 58822734 PREQTNBMEVNMLQ-NTCAYCPXSA-N 357.387 2.924 50 40 FFGB C#CCOc1ccc(OC)cc1/C=N\NC(=O)Cc1ccc(CC)cc1 409361790 DIHPZKBPXTXKFQ-JCMHNJIXSA-N 350.418 2.962 50 40 FFGB C[C@@H](NC(=O)/C(C#N)=C\c1ccc2c(c1)n(C)c(=O)n2C)c1ccccc1 409229599 RRZLUXXPADOTOB-RQNDZEIBSA-N 360.417 2.661 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2cccnc2)cc(Br)c1O 847894 LYNCBWCKQOXUPX-QGMBQPNBSA-N 364.199 2.712 50 40 FFGB Cc1ccc(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 2623880 AITSQSRREROHJJ-UHFFFAOYSA-N 359.407 2.765 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=S)Nc3ccccc3)ccc21 13865545 OSAPQKPCMMYLNH-UHFFFAOYSA-N 353.451 2.996 50 40 FFGB CC/C(=N\NC(=O)CNC(=O)/C=C/c1ccccc1OC)c1ccccc1 5231266 HDVCGUVHUAYDLH-NHIVPECKSA-N 365.433 2.755 50 40 FFGB O=C(COc1ccccc1Cl)NNC(=O)Cc1ccc(Cl)cc1 6448532 FBPJUKQYRHCXBL-UHFFFAOYSA-N 353.205 2.762 50 40 FFGB O=C(N/N=C/c1cc(Br)c(Br)o1)c1ccccn1 4898959 ASYGOFINWDYVRL-GIDUJCDVSA-N 373.004 2.964 50 40 FFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)c1ccccc1O)C(=O)N2 17783206 QNQAKFBWOLVJCL-UHFFFAOYSA-N 374.194 2.549 50 40 FFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)NC(C)(C)C)c1C 408969444 NOYCNHIJOINWMD-CIAFOILYSA-N 354.454 2.767 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc(OC)c(O)c(OC)c2)cc1 408818007 OQXJSKZICNDPJR-NVNXTCNLSA-N 368.389 2.641 50 40 FFGB COc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)COc1cccc(Cl)c1 1021132 DEWXRWJUDWQAHC-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB O=C(N/N=C/c1ccc(F)cc1)C(=O)Nc1cccc(C(F)(F)F)c1 3071386 PBLLXQCWWPWGRL-ZVBGSRNCSA-N 353.275 2.933 50 40 FFGB CCOc1cc(/C=C(/C#N)C(N)=O)ccc1Oc1nc(Cl)ncc1F 5953522 ZVYQMSCZZQUESZ-YHYXMXQVSA-N 362.748 2.852 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cc2ccccc2oc1=O 2626962 QKOISDNEFQTTFD-UHFFFAOYSA-N 372.764 2.530 50 40 FFGB O=C(CCCSc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1 3430448 PWJCJAQBSBEFDW-KRWDZBQOSA-N 372.446 2.546 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCCC1)c1ccccc1 20207324 DYQKVWYRLKZUON-UHFFFAOYSA-N 351.472 2.669 50 40 FFGB COc1cccc(C(=O)N/N=C/c2cc(Br)c(O)cc2O)c1 408726273 MTLCEQBUEIYFJY-CAOOACKPSA-N 365.183 2.633 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1cc([N+](=O)[O-])ccc1O 409047490 NZRKHQKGCWMJLL-FRKPEAEDSA-N 364.701 2.626 50 40 FFGB O=C(CN1C[C@H](c2ccccc2)CC1=O)N/N=C/c1c[nH]c2ccccc12 408974175 WKXXEINZWGOSFX-PLVXZXGYSA-N 360.417 2.634 50 40 FFGB Cc1cccc(C)c1NC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br 408682692 GPWNQOITJRBOCC-BQVODAHPSA-N 364.239 2.813 50 40 FFGB COc1cc(/C=N\NC(=O)COc2cccc(C)c2C)cc(OC)c1OC 30713629 FBZMJVRFUPVTEY-NHDPSOOVSA-N 372.421 2.858 50 40 FFGB COc1cc(OC)c(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c(OC)c1 33750750 PVRGXVAVHRJLGF-WQLSENKSSA-N 354.362 2.964 50 40 FFGB CNC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(N3CCOCC3)cc2)c1C 824406 DGVQVJPHCBMCKV-AQTBWJFISA-N 364.449 2.584 50 40 FFGB O=C(COc1ccc(C2CCCCC2)cc1)NNC(=O)c1ccncc1 5750444 DBKBQERHDWGYNX-UHFFFAOYSA-N 353.422 2.969 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1cccc(Br)c1 5515181 YJLALTWBBCIUGW-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB NC(=O)N/N=C/c1c(Sc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 59417379 OQMKMEJRXSRHGB-LZYBPNLTSA-N 361.339 2.656 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2cc(OC)cc(OC)c2)cc1 100676514 WVYYOPLEFBGHFJ-PDGQHHTCSA-N 374.418 2.963 50 40 FFGB O=C(N/N=C/c1ccc(N2CCOCC2)o1)c1cccc(C(F)(F)F)c1 38191030 MXDHUQOHVGOBBW-SRZZPIQSSA-N 367.327 2.899 50 40 FFGB O=[N+]([O-])C1=C([N+](=O)[O-])[C@H](S[C@H]2[C@H]3CC[C@H](C3)[C@H]2Br)C=C1 5031484 HSONDIAAORAILM-RORKOWFSSA-N 361.217 2.985 50 40 FFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)Cc2ccccc2)c(OC)c1 5288649 OPBLEBCUOXJNOL-HYARGMPZSA-N 369.421 2.767 50 40 FFGB CC(/C=C/c1ccc2c(c1)OCO2)=N/NC(=O)[C@H]1COc2ccccc2O1 4954942 PFQKZUJMDVQXRX-YPAWGPEESA-N 366.373 2.761 50 40 FFGB CCOc1ccc(NC(=O)C/C(C)=N/NC(=O)c2ccc(O)cc2O)cc1 4904246 LDZKKPHBAPLDJP-CIAFOILYSA-N 371.393 2.631 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C(\C)c2ccc(OC)cc2OC)c1 6685689 XMYGCJISFYXPEA-UDWIEESQSA-N 358.394 2.875 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)CCc2c(C)n[nH]c2C)c(O)c1 12411682 PIYHONQDKIAGCM-NDENLUEZSA-N 357.458 2.661 50 40 FFGB CN1[C@H]2[C@H](Br)CCCCN2c2ccc(F)cc2S1(=O)=O 8132305 OOTIIPYEXYSBQL-ZWNOBZJWSA-N 363.252 2.540 50 40 FFGB Cc1ccccc1C(=O)N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 9201581 OXPFFGSTSHLWCZ-DEDYPNTBSA-N 368.393 2.504 50 40 FFGB C/C(=C/C(=O)C(F)(F)C(F)(F)F)NNC(=O)c1ccc(N(C)C)cc1 101376156 JTGRJXIPHILYRQ-HJWRWDBZSA-N 365.302 2.658 50 40 FFGB O=C(NNc1ncnc2c1cnn2-c1ccc(F)cc1)C1CCCCC1 17169486 RWANFILVCGXQIQ-UHFFFAOYSA-N 354.389 2.978 50 40 FFGB C=CCc1ccccc1OCC(=O)N/N=C/c1ccc(OC)c(OC)c1 3168538 HZLGUMQZFMCAAM-FYJGNVAPSA-N 354.406 2.961 50 40 FFGB COc1ccc(OC)c(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)c1 4984754 OPVWQINPZRNZJL-KPKJPENVSA-N 369.333 2.863 50 40 FFGB COc1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1OC 32795428 YACIGUSGROSTJG-UHFFFAOYSA-N 363.801 2.501 50 40 FFGB Cc1cccc(C)c1OCC(=O)NNC(=O)COc1c(C)cccc1C 6860804 YXLPSXLZBDGKGG-UHFFFAOYSA-N 356.422 2.525 50 40 FFGB C=CCN1C(=O)/C(=N\NC(=O)c2cc(-c3ccccc3)n[nH]2)c2ccccc21 4066972 ZHQVXVLMOLGIRG-CLCOLTQESA-N 371.400 2.743 50 40 FFGB COc1cccc(/C=N\NC(=O)COc2cccc3cccnc23)c1OC 409022715 QENTXRDRBSZGTN-UUYOSTAYSA-N 365.389 2.781 50 40 FFGB C#CCn1cc(/C=N/NC(=O)Cc2ccc3c(c2)OCCO3)c2ccccc21 409359242 APEDGKZZDYNDEZ-OEAKJJBVSA-N 373.412 2.739 50 40 FFGB C=CCn1c(SCC(=O)/C(C#N)=C(/C)N)nc2ccc(Cl)cc2c1=O 104415603 INQYHNUQDJPDQM-RAXLEYEMSA-N 374.853 2.653 50 40 FFGB COc1cc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)ccc1O 1305430 TWBUWRYKLIXUOO-GIJQJNRQSA-N 356.407 2.520 50 40 FFGB COc1cccc2c1NC(=O)/C2=N\NC(=O)c1cccc(Br)c1 59472660 YWXUDKCLQGLHJA-UHFFFAOYSA-N 374.194 2.544 50 40 FFGB C/C(CC(=O)NCCCc1ccccc1)=N\NC(=O)Cc1cccs1 101513172 FRQGCCDJTMGKKZ-RCCKNPSSSA-N 357.479 2.922 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])c3cccnc3c2O)cc1 59459113 QRGAJWZBBKQRRB-KEBDBYFISA-N 366.333 2.621 50 40 FFGB CCOc1ccc(CC(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)cc1 408711995 UNNNIELFJLMYNN-KGENOOAVSA-N 354.406 2.939 50 40 FFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1 33856726 SFSDWYATCCMKLD-UFWORHAWSA-N 359.769 2.791 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)c2ccc([N+](=O)[O-])cc2)cc1OC 5480016 QEOUVDMVCJXDCL-XDHOZWIPSA-N 357.366 2.695 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc(OC)c1O 2744685 QUYLDWSYFDUCDS-FYJGNVAPSA-N 365.389 2.964 50 40 FFGB CN1/C(=C(\C#N)C(=O)CSc2nc(C3CC3)n[nH]2)Nc2ccccc21 102644607 QXRLESJMAZEKNK-LFIBNONCSA-N 352.423 2.640 50 40 FFGB CCOC(=O)[C@@H](CCC(=O)OC)P(=O)(c1ccccc1)c1ccccc1 3067390 KUUHDAROGPXGHH-GOSISDBHSA-N 374.373 2.885 50 40 FFGB O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)Nc1ccccc1 2562080 IGNOFJDIKCXHSF-UHFFFAOYSA-N 353.300 2.937 50 40 FFGB CC1(C)CC(=O)C2=C(C1)N1CCc3ccccc3[C@@H]1C/C2=N\NC(N)=O 4029276 KRJRTJDGLJQBTE-WXUSHSQQSA-N 352.438 2.657 50 40 FFGB biogenic C/C(=N\NC(=O)c1ccccc1Br)c1c(O)cc(C)oc1=O 4156073 PNEZTLUAKGJXQE-RQZCQDPDSA-N 365.183 2.570 50 40 FFGB CSc1ncc(Cl)c(C(=O)NNC(=O)c2ccccc2Cl)n1 13625209 WJXSEEAYSGWGLU-UHFFFAOYSA-N 357.222 2.580 50 40 FFGB O=C(Cc1ccc(F)cc1)NNC(=O)c1ccc(OC(F)(F)F)cc1 8415518 LRYNEKKSRRRCJS-UHFFFAOYSA-N 356.275 2.728 50 40 FFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 409041153 IQGIYDJFAVAOKE-QGMBQPNBSA-N 361.741 2.670 50 40 FFGB Cc1cc(/C=N/NC(=O)c2ccccn2)c(C)n1NC(=O)c1ccccc1 8334538 YXYXXLMMXJOTCC-LPYMAVHISA-N 361.405 2.648 50 40 FFGB Cc1cccc(C)c1OC[C@@H](C)NC(=O)NNC(=O)c1ccc(C#N)cc1 58161378 RMNMLZXZVZSUCM-OAHLLOKOSA-N 366.421 2.587 50 40 FFGB O=C1c2ccccc2C(=O)N1C[C@H]1c2ccccc2CCN1C(=O)CCl 2287358 OUORWLBPGMCLSS-KRWDZBQOSA-N 368.820 2.647 50 40 FFGB Cc1c(C(=O)NNC(=S)Nc2ccc(Cl)cc2)nc2ccccn12 5266904 NILZVUXEDYEAJW-UHFFFAOYSA-N 359.842 2.928 50 40 FFGB COc1cc(C(=O)N/N=C(\C)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 5381690 TUTVVYGHQIETMW-YBFXNURJSA-N 373.365 2.775 50 40 FFGB COC(=O)COc1ccccc1/C=N\NC(=O)c1cc2ccccc2o1 17167026 IOBQTRDSFSWRRZ-JAIQZWGSSA-N 352.346 2.749 50 40 FFGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1ccc2c(c1)OCO2 408721567 UBXYYRSHPNARGU-FBCYGCLPSA-N 356.769 2.789 50 40 FFGB CCc1ccc(/C=N/NC(=O)C(=O)NCCc2ccccc2Cl)cc1 3057246 YQWLURQNECBHAG-LPYMAVHISA-N 357.841 2.711 50 40 FFGB C/C(=N\NC(=O)COc1cccc(Br)c1)c1ccc(N)cc1 13286595 QKJRXYCLMSDLKS-YBFXNURJSA-N 362.227 2.951 50 40 FFGB CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1 59514916 YGAZDIGGIWJUTD-CIAFOILYSA-N 367.405 2.970 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc(OC)c(OC)cc2Cl)c(O)c1 409392197 NWNXKFCXPZJYQP-DJKKODMXSA-N 364.785 2.835 50 40 FFGB O=C(CN1CCCC1=O)N/N=C1/C[C@@H](c2ccccc2)Oc2ccccc21 84525295 LYTQDIZOTHOTGK-WDUNQMNWSA-N 363.417 2.653 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)[C@@H]1C[C@H]1c1ccccc1 872290 HCSOFUOFDZTDKE-JKSUJKDBSA-N 358.825 2.978 50 40 FFGB CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@H]1c1ccc(OCC)cc1 1471961 LZRGOEDRHQYKHM-OAHLLOKOSA-N 362.813 2.949 50 40 FFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccc(Br)o1 3073366 XLYFZFUXIGROSQ-GFCCVEGCSA-N 353.172 2.687 50 40 FFGB CC(C)NC(=O)COc1ccc(/C=N/NC(=O)Nc2ccccc2)cc1 28215625 HPQALLYCDHUMTL-UDWIEESQSA-N 354.410 2.746 50 40 FFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C/c3cccc(OC)c3)CC2=O)cc1 4703048 NYFLEOBIMJOXLV-KOWBDXASSA-N 365.433 2.761 50 40 FFGB N#C/C(=C/c1ccc(Br)cc1)C(=O)NCCN1CCCCC1 15230298 FHADFUZUQKOSPZ-QINSGFPZSA-N 362.271 2.958 50 40 FFGB CCS(=O)(=O)[C@H](I)[C@H](O)c1cccc(Cl)c1 96519236 KAADRHASOWQEQP-ZJUUUORDSA-N 374.627 2.569 50 40 FFGB Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c(C)c1 102612199 HNVOSKZUPCGDGB-DKJTXKKOSA-N 364.239 2.813 50 40 FFGB CCOc1cccc(NC(=O)CCNC(=O)[C@H](Br)CC)c1 8733199 XVWHZYAVHWCDLH-CYBMUJFWSA-N 357.248 2.704 50 40 FFGB O=C(CCCSc1nc2ccccc2[nH]1)NNC(=O)c1ccccc1 12535614 KZQOFJPOXPOSRR-UHFFFAOYSA-N 354.435 2.896 50 40 FFGB COc1cc(/C=N/NC(=O)CSc2nc3ccccc3o2)ccc1O 1217456 PGJPZKDKAIILEY-GIJQJNRQSA-N 357.391 2.784 50 40 FFGB CC(C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2Cl)cc1 4600519 WKXBMSVZTBABLI-SRZZPIQSSA-N 373.840 2.894 50 40 FFGB COc1cc(/C=N\NC(=O)c2cn(C)c3ccccc23)cc(OC)c1OC 33330196 MSLFDDZDRLVNIB-NHDPSOOVSA-N 367.405 2.968 50 40 FFGB CC(C)(C)OC(=O)N1CCC(C(=O)NNc2cccc(Cl)n2)CC1 96361314 QKOOLZRXCSVANO-UHFFFAOYSA-N 354.838 2.825 50 40 FFGB COc1ccc2cc(OCC(=O)N/N=C/c3c(C)nn(C)c3F)ccc2c1 252483972 FLNKBHICXSZAGX-UFFVCSGVSA-N 370.384 2.559 50 40 FFGB C[C@@]1(C(=O)N/N=C/c2ccco2)CC1(Br)Br 2752183 RVOSTVGDFJFYCJ-DHIBQTOVSA-N 350.010 2.626 50 40 FFGB COc1ccc(NC(=O)COc2ccc(/C=N\NC(=O)C(C)C)cc2)cc1 58883338 SAJZBIPZWKFOHD-MTJSOVHGSA-N 369.421 2.819 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)c2ccco2)c2cc(Br)ccc21 100192363 SRRBYKSLHKIYQX-GHRIWEEISA-N 362.183 2.543 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)Nc1ccccc1 44835508 ZGOJIOHTAFLHEC-CPNJWEJPSA-N 369.381 2.587 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)COc2c(C)cccc2C)c2ccccc21 13896293 CLTNNGNXYSMFAM-NMWGTECJSA-N 365.433 2.959 50 40 FFGB Cc1ccc(/C=N/NC(=O)[C@@]2(C)CC2(Br)Br)o1 2750943 MEDTUWQKBGNICA-UAYPQDMZSA-N 364.037 2.934 50 40 FFGB O=C(COC(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1Cl 7939771 ZMGXZGUNFHGMEJ-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB NNC(=O)c1ccc([C@@H]2c3sc(=O)[nH]c3S[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)cc1 245241595 KJTWZWQRLVXAGM-PEDHHIEDSA-N 373.503 2.692 50 40 FFGB O=S1(=O)C[C@H](OC(Cl)(Cl)C(Cl)(Cl)Cl)[C@@H](Cl)C1 12175825 BADYEMQWKWXDSG-IMJSIDKUSA-N 370.896 2.909 50 40 FFGB N#CC(=C1Nc2ccccc2N1)c1nc(C#N)c(C#N)nc1N1CCCCC1 791356 ZXJUNZSTUJNGTA-UHFFFAOYSA-N 368.404 2.940 50 40 FFGB COc1cc(/C=C(\C#N)c2nc(N)nc(N(C)C)n2)ccc1OCC(C)C 11335636 FOUYGIMNMIIEEL-RIYZIHGNSA-N 368.441 2.627 50 40 FFGB NC(=O)N/N=C/C1=C(N2CCOCC2)/C(=C/c2ccc(Cl)cc2)CC1 71884668 RMLHYHMLIINTSM-CONBCKQJSA-N 360.845 2.758 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O)c1ccccc1 408771111 CLUSFZFOZLKHFH-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB O=C(N/N=C/c1ccccc1)C1CCN(C(=O)c2ccc(F)cc2)CC1 409004278 BRWODGNYVXCBAI-HYARGMPZSA-N 353.397 2.828 50 40 FFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=O)Cc1ccccc1F 40160428 HXBYPAWZABWZHR-UHFFFAOYSA-N 371.195 2.901 50 40 FFGB C#CCOc1ccc(/C=N/NC(=O)Cc2ccc(OCC)cc2)cc1OC 10475973 QMVLCZKXKXFCOU-PXLXIMEGSA-N 366.417 2.799 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C/c2ccc(OC(C)C)cc2O)c1 8811077 YTHUEBCLLXATOD-RGVLZGJSSA-N 358.394 2.961 50 40 FFGB C[C@H](SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1)C(=O)N(C)c1ccccc1 12622479 SKLFTOMMQHVGHQ-GXTWGEPZSA-N 368.462 2.802 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1ccc(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])o1 59334574 HIZPHJFHDNCNKY-YFHOEESVSA-N 356.294 2.758 50 40 FFGB O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)c1cnccn1 11224488 ZBWVAEMFOXNVNJ-DUXPYHPUSA-N 370.718 2.623 50 40 FFGB CCNC(=S)NNC(=O)Cn1c(-c2ccc(C)cc2)csc1=S 2655527 ROFMOMORTLCMGG-UHFFFAOYSA-N 366.537 2.770 50 40 FFGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)c1ccc(Br)cc1 409305701 WSXVUYCUPQCQLF-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 11290316 ANGNGKZVCDFINN-RVDMUPIBSA-N 354.362 2.704 50 40 FFGB NNC(=O)CNc1c(-c2c[nH]c3ccccc23)nc2ccc(Cl)cn12 35615885 KWMIUHSGWODKPM-UHFFFAOYSA-N 354.801 2.538 50 40 FFGB N#C/C(=C\c1ccc(OCC(=O)O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 2123260 KNMWFOOMSUYCJF-MDWZMJQESA-N 367.317 2.604 50 40 FFGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2O)o1)c1ccccn1 408723571 WTQHBUXLBQYZCS-VXLYETTFSA-N 352.306 2.719 50 40 FFGB CC1=CC(=O)C2=C(C)C[C@H](OC(=O)[C@H](C)Cl)[C@H]3[C@H](C)C(=O)O[C@@H]3[C@@H]12 4073765 QBCFETYQOSWQTI-WYBKVBSMSA-N 352.814 2.569 50 40 FFGB biogenic O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1ccccc1-n1cccc1 409105297 MJWZBKFXSBWEBI-XDHOZWIPSA-N 350.334 2.855 50 40 FFGB CCOC(=O)/C(C#N)=C/c1ccc(Sc2nnnn2-c2ccccc2)o1 408987627 BLBLEFTZQHLQEG-ZRDIBKRKSA-N 367.390 2.877 50 40 FFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)C)c32)c(OC)c1OC 5052105 CMNSVWCCTHXWMS-ZDUSSCGKSA-N 370.409 2.777 50 40 FFGB COc1cc(C(=O)N/N=C\c2c[nH]c3ccccc23)cc(OC)c1OC 35461139 VHTOJACGUMRGKR-NHDPSOOVSA-N 353.378 2.958 50 40 FFGB Cc1ccc(-c2noc(CCC(=O)NNC(=O)c3ccccc3F)n2)cc1 18946174 ZEGDVKKFYOHFQA-UHFFFAOYSA-N 368.368 2.578 50 40 FFGB O=C(Cc1ccccc1)Nc1ccc(C(=O)NNC(=O)c2ccccc2)cc1 881398 QYUWJSMMYLKZMY-UHFFFAOYSA-N 373.412 2.943 50 40 FFGB C/C(CC(=O)NC(C)(C)C)=N\NC(=O)c1cccc(Br)c1 100571738 GKSYXNRDCXRBHM-VCHYOVAHSA-N 354.248 2.860 50 40 FFGB Cc1ccccc1OCC(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1 4698660 BXZWNJNLEWRQKV-UHFFFAOYSA-N 370.449 2.898 50 40 FFGB O=C(N/N=C/c1cccc(Cl)c1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 409257636 RLQHLLOOCZNOLN-IMRMQAIZSA-N 359.788 2.982 50 40 FFGB O=C(CCSc1ccccc1)N/N=C/c1ccc(N2CCOCC2)o1 408993185 VBLAMQRPABSCOG-XMHGGMMESA-N 359.451 2.749 50 40 FFGB C[C@H](SCc1ccccc1)C(=O)NNC(=O)c1cc(Cl)cn1C 44379058 AQNVSWTWLGSCNO-NSHDSACASA-N 351.859 2.761 50 40 FFGB C#CCn1cc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccccc21 6312116 IGSDKXWCLFCRAF-FYJGNVAPSA-N 360.373 2.876 50 40 FFGB Cc1ccccc1C(=O)Nc1ccc(C(=O)NNC(=O)C(F)(F)F)cc1 672501 VISHNFDRJITLIC-UHFFFAOYSA-N 365.311 2.571 50 40 FFGB Cc1cccc(OCCC(=O)NNC(=O)COc2ccccc2Cl)c1 6448387 OQKPYIDNBSTFPC-UHFFFAOYSA-N 362.813 2.644 50 40 FFGB Cc1ccc(Cl)cc1-c1ccc(/C=N/NC(=O)CN2CCOCC2)o1 59246926 AJRRNEFWBHRQLS-RGVLZGJSSA-N 361.829 2.691 50 40 FFGB CC1=C(C#N)C(=O)N(CC(C)C)C(=O)/C1=C\Nc1ccc2c(c1)OCCO2 8992429 ZVULMIIPMZBYPY-YBEGLDIGSA-N 367.405 2.618 50 40 FFGB CC(=O)Nc1cccc(C(=O)NNC(=O)c2ccccc2-n2cccc2)c1 6830966 LMCLFCWFDBJATQ-UHFFFAOYSA-N 362.389 2.511 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)NC(C)C)c(Br)cc1O 408786523 RYMMLPHMQAYNTQ-WZUFQYTHSA-N 353.216 2.985 50 40 FFGB O=C(NNC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1ccc(F)cc1 54952176 SQIDGSKNGSNOOK-UHFFFAOYSA-N 355.369 2.675 50 40 FFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc1OC 2502498 PWSKEUUVCYKBSQ-GOSISDBHSA-N 352.346 2.651 50 40 FFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(O)c(Cl)c1 409261583 DVTJOWPVBYZBSE-VXLYETTFSA-N 361.785 2.533 50 40 FFGB N#C/C(=C\c1ccc(-c2ccccc2C(=O)O)o1)C(=O)NC[C@H]1CCCO1 408734891 LFLLQCUVRZOQBP-NRMKIYEFSA-N 366.373 2.847 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)C(=O)Nc2ccc(OC)cc2)cc1 211027539 ICOWQLQGABZKEZ-STZFKDTASA-N 368.437 2.630 50 40 FFGB CCOc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OC 33699608 XCRMJOCKVOMJEX-UNOMPAQXSA-N 357.366 2.695 50 40 FFGB C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)Cc1ccccc1 100923042 GWVIAPUKJKWDOJ-PXLXIMEGSA-N 352.438 2.816 50 40 FFGB Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccco3)cc2)c1 6034669 ZQVWEQBXUMBQBN-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB O=C(N/N=C/c1cccc(Cl)c1)c1ccc(CN2CCOCC2)cc1 23358536 PMILORWRCIEORN-FYJGNVAPSA-N 357.841 2.936 50 40 FFGB C[C@H]1C=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3)[C@]2(C)CN1C 35212997 MNEKLXLKKDRVIN-YHJVDBJQSA-N 361.424 2.959 50 40 FFGB N#C/C(C(N)=O)=C1/S[C@@H](Cc2ccc(F)cc2)C(=O)N1c1ccccc1 2327963 IGIOFTOWUNDNPY-JQSQVVPISA-N 367.405 2.737 50 40 FFGB CN(C)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2)cc1 3428728 VGQQNGLFFHNRFA-UHFFFAOYSA-N 362.227 2.590 50 40 FFGB CCOc1ccc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc1OC 4675413 VVCQIZXUMLRPOW-YBFXNURJSA-N 373.365 2.531 50 40 FFGB Cc1cc(C)nc(NNC(=O)c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)n1 14511819 WWOVJYAMXIYGCP-UHFFFAOYSA-N 370.413 2.749 50 40 FFGB COc1cc(Cl)c(/C=N/NC(=O)CNC2CCCCC2)cc1OC 409382910 XRTLFAMIZIJJGO-KEBDBYFISA-N 353.850 2.730 50 40 FFGB COc1cc(/C=N\NC(=O)CCn2c(C)nc3ccccc32)ccc1O 35618488 MVRAHFMJHPXMTI-NDENLUEZSA-N 352.394 2.599 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1 5007661 LTMHPXUQXAKDPG-XYOKQWHBSA-N 374.780 2.968 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@H]2CC=C[C@H]12)N/N=C1\C[C@H]2CC=C[C@H]12 5725509 KVMHVJCPUHROLG-IAHRZDGWSA-N 354.454 2.683 50 40 FFGB COc1ccc(S(=O)(=O)NNC(=O)Nc2cccc3ccccc23)cc1 823242 MMSMRQHKIMZROH-UHFFFAOYSA-N 371.418 2.863 50 40 FFGB O=C(N/N=C/c1cc(Br)c(N2CCCC2)o1)c1ccncc1 59249703 XKHDWVXJBRPHSE-VCHYOVAHSA-N 363.215 2.801 50 40 FFGB CCCOc1ccc(C(=O)N/N=C/c2cccc(OCC(=O)OC)c2)cc1 20197876 CIFYLSQDIRZJSU-FYJGNVAPSA-N 370.405 2.791 50 40 FFGB O=C(NNC(=O)c1cccc(Cl)c1)c1ccc(OC[C@@H]2CCCO2)cc1 2645782 PMKALYYIASKDJU-KRWDZBQOSA-N 374.824 2.973 50 40 FFGB CC1(C)[C@H](O)[C@@]2(Br)CC[C@@]1(CC(=O)O)[C@H]2Br 242463982 DRSFYJASRKYEEL-JZSSXWJLSA-N 356.054 2.539 50 40 FFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@@H](c1ccccc1)C(C#N)=C(N)O2 2258127 RXXVCDUJUZJSCT-QAPCUYQASA-N 363.417 2.554 50 40 FFGB O=C(NNC(=O)c1ccccc1Cl)c1ccc(OC[C@@H]2CCCO2)cc1 13619606 RKZRCPBBQZSFHF-HNNXBMFYSA-N 374.824 2.973 50 40 FFGB CC(C)Oc1ccc(/C=N/NC(=O)CC(=O)NCCc2ccccc2)cc1 408718567 ZMZLIBJPFPZZMC-HZHRSRAPSA-N 367.449 2.673 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)NCCc2ccccc2)c(OC)c1OC 33676957 UBPBMDYIHPTSJD-LGMDPLHJSA-N 366.417 2.978 50 40 FFGB Cn1nc(C(F)(F)F)c([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)c1Cl 253406962 VJGJVRSSNFGETH-SECBINFHSA-N 372.734 2.907 50 40 FFGB Cc1ccccc1C(=O)N/N=C1\C(=O)N(CN2CCCC2)c2ccccc21 3255956 AUSZRBYPDKUQIH-QOCHGBHMSA-N 362.433 2.529 50 40 FFGB CC[C@H](Oc1ccc(C)cc1)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 12137414 GWWXLCHTABPBNI-INIZCTEOSA-N 357.366 2.522 50 40 FFGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1ccncc1 840411 GNTZIFRDIHKRCY-SECBINFHSA-N 354.193 2.617 50 40 FFGB Cc1c(C(=O)NNC(=O)c2ccncc2)oc2ccc(Br)cc12 5423491 UHQLSMWHWCAZIW-UHFFFAOYSA-N 374.194 2.974 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1 60512601 AUQHGGYCNCMORO-UDWIEESQSA-N 358.394 2.875 50 40 FFGB Cc1occc1C(=O)NNC(=O)c1c[nH]c(=S)n1-c1ccc(F)cc1 16515267 HUXOWHOVPMEJNI-UHFFFAOYSA-N 360.370 2.650 50 40 FFGB NNC(=O)c1csc(-n2nc(-c3ccccc3)cc2C(F)(F)F)n1 8713753 KROXNBHNEYFVLU-UHFFFAOYSA-N 353.329 2.618 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(C)=O 408766599 VVXCIBBSQLFTDV-YBFXNURJSA-N 371.349 2.683 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 408889171 ALKUGPSVBWQHBS-WUXMJOGZSA-N 367.317 2.878 50 40 FFGB CCSc1nc(C)cc(SCC(=O)N/N=C/c2ccccc2O)n1 3130349 PBZILDFDFQFWDE-RQZCQDPDSA-N 362.480 2.845 50 40 FFGB C/C(=N\NC(=O)CNC(=O)c1ccc(Cl)cc1)c1ccc(N(C)C)cc1 5221447 NVNWAXPWQQEJLB-LPYMAVHISA-N 372.856 2.676 50 40 FFGB Cn1cccc1C(=O)NN[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1 40007537 AQKVJWZZJAKMCK-GOSISDBHSA-N 366.396 2.779 50 40 FFGB COc1ccccc1/C=N/NC(=O)CSCc1ccc([N+](=O)[O-])cc1 20248269 BTZIELONUFHPON-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB O=C(N/N=C/c1ccc(Cl)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O 3465899 GDJBMXYCCNUIMB-FRKPEAEDSA-N 364.701 2.626 50 40 FFGB N#C/C(=C\c1ccccc1OCC(N)=O)C(=O)Nc1ccccc1Cl 409219404 QAQDIGNAJZEKNJ-UKTHLTGXSA-N 355.781 2.750 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2cc(C)n(-c3nccs3)c2C)c(C)o1 125079636 XHZUBPLKLWPLEE-UHFFFAOYSA-N 358.423 2.835 50 40 FFGB CNc1snc(C)c1C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 16971283 XAZIJIAJAKZILM-UHFFFAOYSA-N 362.499 2.861 50 40 FFGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)NCc1ccccc1 855539 MASZQVMGWXIXRJ-MKMNVTDBSA-N 351.318 2.547 50 40 FFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCSc1ccccc1 6405141 HTDPRQFOHHYWAO-CYBMUJFWSA-N 362.426 2.923 50 40 FFGB FC(F)(F)C1(C(F)(F)F)[C@@H]2C[C@@H]3[C@@H]([C@H]2I)N31 100122208 DTKNYSHMNMVGAO-PSEOZTEZSA-N 357.035 2.740 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@@H](OC)c2ccccc2)c(OC)c1OC 1425052 GACORYVLZZHMNF-RONKMWSCSA-N 358.394 2.550 50 40 FFGB CC(C)CCn1c(CCl)nc2c1c(=O)[nH]c(=O)n2Cc1ccccc1 3888478 DWMRPIUUAXUEDA-UHFFFAOYSA-N 360.845 2.720 50 40 FFGB CC/C(C)=N/NC(=O)c1sc(NS(=O)(=O)c2ccccc2)nc1C 3991883 FFOAZDWYFJFDNV-LICLKQGHSA-N 366.468 2.768 50 40 FFGB CC[C@@H](C)NC(=O)/C(C#N)=C/c1cc2c(cc1Br)OCO2 408818975 WAXNXWHNGWBLPA-VMDVGJCFSA-N 351.200 2.999 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 33763436 RTSRMWRYVGKIOM-YBFXNURJSA-N 373.365 2.775 50 40 FFGB COc1cc(/C=N/NC(=O)c2cccc(O)c2)cc(Br)c1O 726949 AOFCCEVSUMXOEC-CAOOACKPSA-N 365.183 2.633 50 40 FFGB Cc1cc(C)c(NCC(=O)NNC(=O)N(C)Cc2ccsc2)c(C)c1 32795287 LRJQVFXZTGOWEA-UHFFFAOYSA-N 360.483 2.958 50 40 FFGB CCC(=O)NNC(=O)CSc1nc(C2CC2)nc2sc(C)c(C)c12 4218035 MAGBRTNNKXGNOP-UHFFFAOYSA-N 364.496 2.835 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(OC)cc1 4502844 NTKPGOKDFUDETA-HNNXBMFYSA-N 370.434 2.643 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])c(C)c1 6271116 YUBYBHIWEVVLMT-UHFFFAOYSA-N 363.757 2.640 50 40 FFGB COC(=O)[C@@](O)([C@H](Cl)C(=O)Nc1cccc(Cl)c1C)C(F)(F)F 2115273 KFKCVTWBLHBRMR-SKDRFNHKSA-N 374.142 2.661 50 40 FFGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc(O)c(O)c1 3577090 ZECAALNHELPNHX-ODCIPOBUSA-N 353.300 2.679 50 40 FFGB O=C(N/N=C1/CCCc2ccccc21)C(=O)N/N=C1/CCCc2ccccc21 39345280 KBUBSOXOOXDCOO-SRPFLQSCSA-N 374.444 2.700 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)COc2ccccc2[N+](=O)[O-])c(OC)c1 16102320 UEFJPVVBPRBALH-XDHOZWIPSA-N 373.365 2.531 50 40 FFGB CC(C)(C)[Si](OCC1(CO)COC1)(c1ccccc1)c1ccccc1 217511432 NWPICNKQTYPJSA-UHFFFAOYSA-N 356.538 2.572 50 40 FFGB COc1cc(OC)c(/C=N/NC(=O)c2cccnc2)cc1Br 5175930 IDECXOGLGKDJQJ-GIJQJNRQSA-N 364.199 2.625 50 40 FFGB C/C(CC(=O)NCc1ccco1)=N\NC(=O)C12CC3CC(CC(C3)C1)C2 100090606 MALUXOKDGLFSFA-LPYMAVHISA-N 357.454 2.994 50 40 FFGB N#CC1=C(N)N(c2nc[nH]n2)C2=C(C(=O)CCC2)[C@H]1c1ccc(Cl)cc1 4503787 LIKGBTNXAGPSHM-HNNXBMFYSA-N 366.812 2.763 50 40 FFGB CN1CCN([P@@](=O)(c2ccccc2)c2nc3ccccc3s2)CC1 8015316 PTKNZVBICBYBJY-HSZRJFAPSA-N 357.419 2.773 50 40 FFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@@H]1c1cccc(Br)c1 57509024 RNCKZAGASHSSEG-GFCCVEGCSA-N 373.634 2.859 50 40 FFGB C/C(=N/NC(=O)[C@H](O)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 4155719 JHMAVHNCLBGAOE-QLTNSANVSA-N 351.406 2.609 50 40 FFGB O=C(COc1cccc(C(F)(F)F)c1)N/N=C1\C(=O)Nc2ccccc21 6864790 KNSQFXRJSVHIET-UHFFFAOYSA-N 363.295 2.557 50 40 FFGB COc1ccccc1NC(=O)N/N=C\c1ccc(O[C@H](C)C(=O)O)cc1 408848396 YNCBZFAHKFNADP-ZDFPAGSVSA-N 357.366 2.703 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc(Br)ccc2O)c(O)c1 409393747 ZVTUYGLICDIBQM-CAOOACKPSA-N 365.183 2.633 50 40 FFGB CCOc1ccc([C@@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1OC 409123949 GDDPVDUSMKNOCJ-GOSISDBHSA-N 353.422 2.824 50 40 FFGB Cc1cc(C)cc(OCCC(=O)NNC(=O)c2cccc(N(C)C)c2)c1 40060237 XMNZOOCHLWHOKP-UHFFFAOYSA-N 355.438 2.600 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1 6169955 OHLJJUPOWRFFOS-UFWORHAWSA-N 362.769 2.850 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1ccc(O)cc1O)CO2 30742906 RFVKPPWNEHMWOF-BYSCUOHCSA-N 370.405 2.685 50 40 FFGB COc1ccccc1C(=O)N/N=C(\C)CC(=O)Nc1ccc(Cl)cn1 100797653 KRJDXJZVSYNSOP-SRZZPIQSSA-N 360.801 2.878 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 409263967 DFGRWRRKTAQAIJ-NIZGNDASSA-N 365.433 2.979 50 40 FFGB O=C(NCC1CC1)N/N=C1/C(O)=Nc2c(Br)cc(F)cc21 64921335 RBYZXDFQQFONQJ-UHFFFAOYSA-N 355.167 2.603 50 40 FFGB CCOc1cccc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c1O 13847755 MZGFPIQVTNTEMU-VXLYETTFSA-N 373.365 2.537 50 40 FFGB CCOC(=O)/C(=C/NNC(=O)c1ccc(C)cc1)C(=O)c1ccccc1 15227507 VWQQEQUQOHIMNO-GHRIWEEISA-N 352.390 2.559 50 40 FFGB CCCCCCC(=O)NNC(=O)c1c(O)n(CCC)c2ccccc2c1=O 5826011 XJJRVYOLCGKCTG-UHFFFAOYSA-N 373.453 2.849 50 40 FFGB COc1ccc(C(=O)NNc2ncnc3c2cnn3-c2ccc(C)cc2)cc1 1299710 XYTWTZPCPOYLSP-UHFFFAOYSA-N 374.404 2.889 50 40 FFGB N#C/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc2c(c1)OCO2 59133342 KJOOKZUOZKMIES-MKMNVTDBSA-N 351.318 2.547 50 40 FFGB O=C(NCc1ccc(Cl)cc1)C(=O)N/N=C/c1cccc(Cl)c1 59515981 LFMZFWXBWJZWIW-KEBDBYFISA-N 350.205 2.760 50 40 FFGB O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc2c(s1)CCCCC2 3409045 BYDQLGOUCPRXLY-HNNXBMFYSA-N 372.446 2.618 50 40 FFGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(N2CCOCC2)o1 408997615 SASVHWDDJAWHRS-NFECSFHCSA-N 359.451 2.747 50 40 FFGB CCCN1C(=O)/C(=N/NC(=O)CNc2cccc(C)c2)c2ccccc21 5694965 ZSOPQRCZACMIJB-FCDQGJHFSA-N 350.422 2.684 50 40 FFGB C=CCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(O)c(Cl)c2)cc1 409258312 UICJRHFWSBCCNK-RGVLZGJSSA-N 373.796 2.699 50 40 FFGB CC1=C(C#N)[C@@H](c2cc3c(cc2[N+](=O)[O-])OCO3)C2=C(CCCC2=O)N1 19805627 TTWLFCAICXEYTA-QGZVFWFLSA-N 353.334 2.815 50 40 FFGB COC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccc(O)c(OC)c1 1453595 VDSBEIQMRDLJBA-UKTHLTGXSA-N 352.346 2.733 50 40 FFGB CCOc1ccc(/C=C(/C#N)C(=O)N(C)C)cc1I 59334152 AKRCSQUYCIIBDC-XFFZJAGNSA-N 370.190 2.685 50 40 FFGB Cc1ccc(-n2nc(NC(=O)NNc3ccccc3)c(C)c(C#N)c2=O)cc1 5546445 MGWAWAJSCSWTCD-UHFFFAOYSA-N 374.404 2.870 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc([N+](=O)[O-])c1O 14134580 WYXIWSOWMRFQCN-VXLYETTFSA-N 357.366 2.619 50 40 FFGB C/C(=N\NC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc2c(c1)CCCC2 5370170 YGZPWBJXFRUANN-PXLXIMEGSA-N 374.448 2.759 50 40 FFGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COC(=O)CCCn1cccn1)C2 102112897 LAERLSOHXYQGIE-YJEYSOHQSA-N 360.458 2.525 50 40 FFGB CN(C)c1ccc(/C=C(\C#N)C(=O)N/N=C/c2ccccc2[N+](=O)[O-])cc1 704234 NBBAGCSMRRMYSU-MUIFUQOHSA-N 363.377 2.718 50 40 FFGB Cc1cc(/C=N/NC=O)c(C)n1-c1ccc(I)cc1 3276069 ZTUXKAHEHUXRML-LZYBPNLTSA-N 367.190 2.779 50 40 FFGB CCc1ccc(CC(=O)N/N=C\c2cc(OC)c(O)c([N+](=O)[O-])c2)cc1 409361762 DEKCLVRZTVUNOE-ODLFYWEKSA-N 357.366 2.564 50 40 FFGB Cc1cc(Cl)ccc1NCC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O 36019050 RFRAJKDWDROSIQ-UFWORHAWSA-N 362.773 2.824 50 40 FFGB CCOc1ccc([C@@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CCC3)cc1 690923 MJUWAAAEVYOMQR-GOSISDBHSA-N 352.438 2.662 50 40 FFGB N#C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1cccc2c1C(=O)NC2=O 2659620 DWZUEDOGSAKJNE-DHZHZOJOSA-N 351.749 2.769 50 40 FFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)cc1 408909518 UUOSOVOWTHOJKD-ALDSOSFCSA-N 369.421 2.503 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)CSc2ncccn2)cc1OCC 408840175 CGBLTNIPJINAJQ-CIAFOILYSA-N 374.466 2.907 50 40 FFGB O=C(N/N=C/c1ccc(O)cc1)C1CCN(C(=O)c2ccc(F)cc2)CC1 409007215 VLPSHMRCRHZTDD-LPYMAVHISA-N 369.396 2.534 50 40 FFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)NC2CCCC2)cc1OC 33721663 OVKSKSCQNFPFJH-GDNBJRDFSA-N 372.421 2.603 50 40 FFGB CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ncnc2ccccc12 1775970406 AQQHSHVOAOFCFK-CQSZACIVSA-N 359.430 2.622 50 40 FFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OC3CSC3)cc2)cc1 5544513 CVTRGFAXDIKORM-KEBDBYFISA-N 369.446 2.578 50 40 FFGB Cc1ccc(N2C(=O)C[C@H](NNC(=O)c3cccc(Cl)c3)C2=O)c(C)c1 100864526 XCLLTWOHKRCWIK-HNNXBMFYSA-N 371.824 2.523 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)CCCOc1ccc(Cl)c(C)c1 104345324 BURIKFLCJYBBSE-OWBHPGMISA-N 350.802 2.676 50 40 FFGB O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1cccc([N+](=O)[O-])c1 1069095 NUJNLQATQBHSPY-RQZCQDPDSA-N 355.379 2.714 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)s1 12805014 NKARNAPHGGFFDW-VIFPVBQESA-N 370.521 2.866 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2cc(OC)ccc2OC)cc1 9061046 IXKGTBGXFAGHAR-FOWTUZBSSA-N 374.418 2.963 50 40 FFGB CCCOc1ccc(C(=O)N/N=C/c2cccc(OCC(=O)O)c2)cc1 20197874 XCNWSDYQFXGPLC-UDWIEESQSA-N 356.378 2.703 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1ccc([N+](=O)[O-])o1)CO2 5642949 ZEHOUGILTBBWID-HBFFOVPNSA-N 373.365 2.775 50 40 FFGB CCOc1cc(/C=N/NC(=O)[C@H](C)Oc2ccc(C#N)cc2)ccc1O 8499847 FRCHGZYYOWPWQU-XMOVILSBSA-N 353.378 2.580 50 40 FFGB C#CCOc1ccc(/C=N\NC(=O)COc2cccc3cccnc23)cc1 409022149 GIYIHPZXGJZCEA-UCQKPKSFSA-N 359.385 2.776 50 40 FFGB CCCCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(F)cc2)c1 408613329 ZBPRDVHKYTWSAX-YDZHTSKRSA-N 371.412 2.771 50 40 FFGB C=CCOc1ccc(NC(=O)C(=O)N/N=C/c2cc(Cl)ccc2O)cc1 409254633 FEWZYOPVORLGAN-RGVLZGJSSA-N 373.796 2.699 50 40 FFGB NNC(=O)/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 226256907 DPEIQHACRZZIAV-ZZXKWVIFSA-N 352.144 2.620 50 40 FFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccncc1 5380587 MXYGNHFZKPRACY-YBFXNURJSA-N 358.195 2.620 50 40 FFGB COc1cc(C(=O)NN)ccc1OCc1cccc(Br)c1 226326818 XJJOPGJSXSACAG-UHFFFAOYSA-N 351.200 2.640 50 40 FFGB CCc1ccccc1NC(=O)C/C(C)=N/NC(=O)C(=O)Nc1ccccc1 4402033 MWXLLDPBLMLHRK-OEAKJJBVSA-N 366.421 2.708 50 40 FFGB CCOC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1 3243867 DQVNXKHCGGIVRO-WLRTZDKTSA-N 366.009 2.997 50 40 FFGB O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccncc1 12950605 SLNJONMPVRFDKP-UHFFFAOYSA-N 365.364 2.875 50 40 FFGB COc1cccc(OCC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1 4568537 QENFYMUCFPNHKM-UHFFFAOYSA-N 356.422 2.833 50 40 FFGB COC(=O)COc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)c1 408832482 QWQZTLMNUQDJPM-MQMKENTISA-N 372.446 2.869 50 40 FFGB CCn1cccc1/C=N/NC(=O)COc1ccc(Br)cc1 408939801 UJZRPPMIFYIQSA-LICLKQGHSA-N 350.216 2.800 50 40 FFGB O=C(S[C@H]1CS(=O)(=O)C[C@H]1Cl)c1ccccc1Br 16789891 VYPSIHSPXGUPES-ZJUUUORDSA-N 369.689 2.727 50 40 FFGB O=C(Nc1ccccc1C(=O)N/N=C/c1ccc(O)cc1O)c1ccco1 6335966 JEAJZXYTONYTDH-RGVLZGJSSA-N 365.345 2.707 50 40 FFGB CC(/C=C/c1ccc2c(c1)OCO2)=N/NC(=O)[C@@H]1COc2ccccc2O1 1226675 PFQKZUJMDVQXRX-SGGJBKKWSA-N 366.373 2.761 50 40 FFGB Cc1cccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1C 102612183 VEPIMNVKKALHAX-DKJTXKKOSA-N 364.239 2.813 50 40 FFGB CN(C)c1cccc(OCC(=O)N/N=C\c2ccc(Br)o2)c1 409000307 YLEJWGFKZYTIKT-MFOYZWKCSA-N 366.215 2.637 50 40 FFGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1OCC 408968068 UBUHATGTSGKPGI-YDZHTSKRSA-N 365.364 2.872 50 40 FFGB O=C(COc1cccc2cccnc12)N/N=C/c1ccc([N+](=O)[O-])cc1 3200610 CBOULLKKCHCUHZ-RGVLZGJSSA-N 350.334 2.672 50 40 FFGB CC(=O)Nc1ccc(S[C@H](C)C(=O)NNc2nc(C)cc(C)n2)cc1 40153404 OOROPFNPUMYSBN-GFCCVEGCSA-N 359.455 2.676 50 40 FFGB Cc1cccc(C(=O)NNC(=O)COc2ccc3ccccc3c2)c1O 829237 QKXXLWKGTAEAQV-UHFFFAOYSA-N 350.374 2.694 50 40 FFGB COc1ccc(Br)c(C(=O)NNC(=O)c2cccs2)c1 8487206 XLKMTPUAERTIFX-UHFFFAOYSA-N 355.213 2.594 50 40 FFGB COC(=O)COc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2F)cc1 408810456 KPTZNQDJLFPKEC-UVTDQMKNSA-N 354.337 2.923 50 40 FFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)NC2CCCC2)c1C 408973787 VEQRHQHASUQBGV-LPYMAVHISA-N 366.465 2.911 50 40 FFGB Cn1/c(=N\NC(=O)c2cc3ccccc3oc2=O)sc2ccccc21 212306187 GFVUHRVYDCPXKO-CZIZESTLSA-N 351.387 2.592 50 40 FFGB O=C(/C=C/c1ccco1)NCC(=O)N/N=C/c1ccc(Cl)cc1Cl 1880718 LEXHZRBCUGGYHD-UVZAAPLCSA-N 366.204 2.866 50 40 FFGB Cc1nc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)c(NN)o1 104479034 QLSFNMFFARFQST-UHFFFAOYSA-N 374.404 2.888 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])c(O)c2ncccc12)c1ccc(F)cc1 59459151 ZGGFAHWPZVMPKY-AWQFTUOYSA-N 354.297 2.752 50 40 FFGB Cc1cc2c(c(=O)n1C)[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 2351227 LROFIWMHLPPMOM-CQSZACIVSA-N 372.222 2.674 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1ccc(O)c(O)c1)CO2 31849123 PAVGBADMXKMVEC-OIQMFWTRSA-N 370.405 2.685 50 40 FFGB N#C/C(=C\c1ccc(-c2ccccc2F)o1)c1nn(CCO)c(N)c1C#N 3901131 JQEQUFAOIRNAMC-FMIVXFBMSA-N 363.352 2.793 50 40 FFGB Cn1c(=O)c2c(c3ccccc31)OC(N)=C(C#N)[C@@H]2c1ccccc1[N+](=O)[O-] 20086113 HAJAFYZCBMGUKD-INIZCTEOSA-N 374.356 2.665 50 40 FFGB O=C(NCCc1ccccc1)C(=O)N/N=C/c1c(Cl)cccc1Cl 7782336 ULSXQDDNVYIHTB-SRZZPIQSSA-N 364.232 2.802 50 40 FFGB N#C/C(=C\c1ccc(OCC(=O)Nc2ccccc2Cl)cc1)C(N)=O 408817340 SZSUXSXVVMJTQE-UKTHLTGXSA-N 355.781 2.750 50 40 FFGB Cc1occc1C(=O)NNC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1 48301759 ACIOBNILDWZGEG-LLVKDONJSA-N 370.409 2.642 50 40 FFGB CCOc1ccc(Cl)cc1/C=N/NC(=O)CNC(=O)c1ccccc1 2175985 IBINZRGFGFUUBW-SRZZPIQSSA-N 359.813 2.619 50 40 FFGB CNC1=C/C(=N/C2=C/C(=N/C(=C\C#N)C(C)(C)O)OC2(C)C)OC1(C)C 17255310 UEVOZOYNOPOHNZ-JABBBUBNSA-N 358.442 2.567 50 40 FFGB COc1cc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)ccc1O 59515517 GLNKMVSTTGCEHO-RGVLZGJSSA-N 355.394 2.613 50 40 FFGB Cc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc(F)cc3)CC2=O)cc1C 409153117 CQGBNJBJWCDZLB-CNPYVQQSSA-N 353.397 2.946 50 40 FFGB Cc1cc(C)nc(NNC(=O)[C@@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)n1 14510721 MEIAZBRVHJCJFJ-CQSZACIVSA-N 369.469 2.653 50 40 FFGB O=C(NNS(=O)(=O)c1ccccc1Cl)c1cc2c(s1)CCC2 7379746 FSSKGYWNZNMKPR-UHFFFAOYSA-N 356.856 2.514 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2ccccc2NC(=O)c2ccco2)cc1 32669218 OAZDIMVCTYAOPV-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB O=C(N/N=C1/CCCc2ccccc21)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 96900724 XTOGSEVMAKOQNH-VLGSPTGOSA-N 354.322 2.973 50 40 FFGB CCOc1cc(/C=C(\C#N)C(N)=C(C#N)C#N)cc(Br)c1O 97959708 PGSPTJXZUWGWBB-XCVCLJGOSA-N 359.183 2.720 50 40 FFGB COc1cc(/C=N/NC(=O)c2cc(-c3ccc(F)cc3)n[nH]2)ccc1O 867715 YLNSRAZJHNGPLC-KEBDBYFISA-N 354.341 2.694 50 40 FFGB O=C(COc1ccc2ccccc2c1)NNC(=O)c1cccc([N+](=O)[O-])c1 829245 PHIZXCQKMDPOSH-UHFFFAOYSA-N 365.345 2.588 50 40 FFGB CC(C)NC(=C(C#N)C#N)[C@]1(C#N)[C@H](c2cccc([N+](=O)[O-])c2)C1(C#N)C#N 78547414 BEFGDEWGNRZEOL-APWZRJJASA-N 371.360 2.535 50 40 FFGB NNC(=O)c1ccc(NC(=O)CSc2nc3ccccc3s2)cc1 1565020 RPKYJMMNBLODPY-UHFFFAOYSA-N 358.448 2.631 50 40 FFGB CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(CC)c(=O)c32)cc1 2242314 ZMIVWFQWRWEHKJ-QGZVFWFLSA-N 351.406 2.794 50 40 FFGB O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1ccoc1 13011694 QVDKKENYSYJOCA-UHFFFAOYSA-N 373.372 2.602 50 40 FFGB C#CCOc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OCC 4570872 ACTSIWDLXYAYTB-LJQANCHMSA-N 364.401 2.912 50 40 FFGB O=C(N/N=C/c1ccc(Cl)cc1)c1ccc(CN2CCOCC2)cc1 23358576 VXNGITNHRRPESG-FYJGNVAPSA-N 357.841 2.936 50 40 FFGB C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N[C@H]1SC(=O)[C@H]1CCCO1 299754519 CYIYODQQOPTSEF-NMKXLXIOSA-N 359.564 2.908 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C(\CCC(=O)O)c1ccccc1 4036716 JBLRUELRAORVSA-LTGZKZEYSA-N 370.405 2.849 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@]12C(=O)Nc1ccc(F)cc12 4168378 RSVVJPXKGUWJEJ-HXUWFJFHSA-N 373.347 2.540 50 40 FFGB CCOC(=O)N1CCC2(CC1)C(C#N)=C(N)OC1=C2C(=O)CC(C)(C)C1 808855 IDUCBGVUBKESCZ-UHFFFAOYSA-N 359.426 2.592 50 40 FFGB CCOc1cc(/C=N/NC(=O)CN2Cc3cc(C)c(C)cc3C2)ccc1O 6960042 MYLKRNHBUALPAW-LSHDLFTRSA-N 367.449 2.874 50 40 FFGB CCC(=O)N1CCN(c2ccccc2[C@H]2C[C@H](C(=O)Cl)CC2=O)CC1 57328015 RZXGKWKGMYYWGI-DZGCQCFKSA-N 362.857 2.573 50 40 FFGB O=C(Cc1cccc2ccccc12)N/N=C/c1ccc(N2CCOCC2)o1 59378211 OBGICSYWNOAREE-PXLXIMEGSA-N 363.417 2.962 50 40 FFGB CCNc1nnc(SCC(=O)/C(C#N)=C2/Nc3ccccc3N2C)s1 96919013 GSHCSUVUZBXSGU-UVTDQMKNSA-N 372.479 2.928 50 40 FFGB CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NNc2ccc(F)c(F)c2F)C1 97597220 YPDHQTYCYHEWGX-SECBINFHSA-N 359.348 2.804 50 40 FFGB CCOc1ccc(OCCC(=O)NNC(=O)c2ccccc2Cl)cc1 12868920 QTZHFFHOCDMOIU-UHFFFAOYSA-N 362.813 2.969 50 40 FFGB COC[C@@H](Cl)/C(N)=N/S(=O)(=O)c1c(C)cc(Cl)cc1Cl 1590897 VYZGISWRCPMPFS-SECBINFHSA-N 359.662 2.602 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1 408969734 SPXZNZYJZSSUGA-NWGMWSOJSA-N 353.422 2.630 50 40 FFGB CCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)cc1OC 33361636 XFYWUDZIQPPNCD-NDENLUEZSA-N 358.394 2.875 50 40 FFGB CC(=O)Nc1ccc(C(C)=NNC(=O)CO/N=C/c2ccccc2)cc1 245226008 CYVUCFLVCUPENU-WVWLKDTLSA-N 352.394 2.536 50 40 FFGB O=C(CSc1nc2ccccc2o1)N/N=C/c1ccc(C(=O)O)cc1 710349 ALFDSGZRVOTTDY-GIJQJNRQSA-N 355.375 2.768 50 40 FFGB COc1ccc(/C=N/NC(=O)CCc2ccc(OC)c(OC)c2)cc1OC 59461528 OKRRHDQFBMVZGR-FYJGNVAPSA-N 372.421 2.804 50 40 FFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1ccccc1 722432 LTYGLNJNJIBLAQ-UHFFFAOYSA-N 363.211 2.598 50 40 FFGB CC(C)Oc1ccc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2)cc1 5381396 OYNICRZUUBNZGV-WSDLNYQXSA-N 373.840 2.894 50 40 FFGB O=C(O)[C@H]1C[C@@H](Sc2ccc([N+](=O)[O-])cc2)[C@@H](Cl)C[C@H]1C(=O)O 36550943 RMVAPMUOFNYPCC-NOOOWODRSA-N 359.787 2.858 50 40 FFGB C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)COc1cccc(C)c1 4697911 LRCTTYXIFOTKQR-PXLXIMEGSA-N 354.410 2.598 50 40 FFGB COc1ccccc1NCC(=O)NNC(=O)c1csc2c1CC[C@@H](C)C2 12533042 AZZOMQMPVZSMPX-GFCCVEGCSA-N 373.478 2.755 50 40 FFGB C[C@@]12CC[C@H]([C@](Br)([N+](=O)[O-])C1=O)[C@@]2(C)CBr 101023792 QNOPRINAANCQME-ZQNVIIHSSA-N 355.026 2.755 50 40 FFGB COc1ccc(NC(=O)C(=O)N/N=C/c2sccc2C)cc1Cl 58884815 GYTKTLHEUDJNQA-CAOOACKPSA-N 351.815 2.807 50 40 FFGB C[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C1CC1 64748561 NMVBOPIKROGZEK-ZDUSSCGKSA-N 352.438 2.572 50 40 FFGB CCOC(=O)N/N=C\c1cc(O)c(Br)cc1Br 71335855 QLUVICQTCZTNQD-ACAGNQJTSA-N 366.009 2.997 50 40 FFGB CCCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2cccs2)c2ccccc21 5204938 ARDUIJBNUKVJRB-PEZBUJJGSA-N 364.430 2.699 50 40 FFGB Cc1cc(OCC(=O)N/N=C2\C(=O)Nc3ccccc32)cc(C)c1Cl 4724009 WBZHXMAJNOAVQU-UHFFFAOYSA-N 357.797 2.808 50 40 FFGB Cc1ccc(S(=O)(=O)N[C@H](Cc2ccccc2)C(=O)CCl)cc1 1569718 MQUQNUAYKLCRME-MRXNPFEDSA-N 351.855 2.693 50 40 FFGB biogenic,in-vitro Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@H]3C[C@@H]2[C@H]4Br)cc1 217424480 GIADFOWGSIJLCB-VPCRRHSYSA-N 350.212 2.505 50 40 FFGB C#CCOc1ccc(Br)cc1/C=N\NC(=O)c1ccncc1 108821583 MXYGNHFZKPRACY-ODLFYWEKSA-N 358.195 2.620 50 40 FFGB COc1ccc(Br)cc1[C@@H]1C(C#N)=C(N)Oc2[nH]nc(C)c21 5013110 FOUHMRCYXVDFKG-CYBMUJFWSA-N 361.199 2.707 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C/c2ccc(Br)o2)c1 107586914 KLWRYLKSUCNDIB-LZYBPNLTSA-N 353.172 2.823 50 40 FFGB CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccco2)CC1=O 12926494 URURFYZFMNUGQA-ZIAGYGMSSA-N 369.421 2.607 50 40 FFGB COc1ccccc1NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1 6787024 QWQZVJIRBUTDRD-UHFFFAOYSA-N 373.409 2.958 50 40 FFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccccc1O)c1ccccc1 408978736 JPAGAUWMPSTTFX-UOEVCUDDSA-N 355.394 2.720 50 40 FFGB COc1ccc(NC(=S)NNC(=O)c2ccc(OC(F)F)cc2)cc1 652769 BIRGXFLIPXFBOX-UHFFFAOYSA-N 367.377 2.928 50 40 FFGB O=C(CN1CCCCC1)NC(=O)N(/N=C/c1ccco1)c1ccccc1 4921179 DABPQKWJWSXAGM-XSFVSMFZSA-N 354.410 2.842 50 40 FFGB Cc1noc(C)c1COc1ccc(C(=O)NNC(=O)c2ccccc2)cc1 5704515 BCUTZHMAOQKKCG-UHFFFAOYSA-N 365.389 2.945 50 40 FFGB O=C(CNc1ccc(F)cc1)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 409343032 HJRKSOIEWOPLKC-UFWORHAWSA-N 350.737 2.950 50 40 FFGB O=C(N/N=C/c1ccccc1OCc1ccc(Cl)cc1)C(=O)NC1CC1 408608232 GWAJZSWVHHKGJS-SRZZPIQSSA-N 371.824 2.648 50 40 FFGB Cc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCCNC2=O)c(C)n1CCC(C)C 98055088 LVTBPKLNNJPFJG-TVNWYLLRSA-N 370.497 2.843 50 40 FFGB C[C@@H](NC(=O)/C(C#N)=C/c1ccc(N2CCOCC2)o1)c1ccccc1 1096164 AVPXLQLWDWTIRN-OVGFGYAMSA-N 351.406 2.901 50 40 FFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)c(OC)c1OC 85409028 XWVURMSTWFAOJY-INIZCTEOSA-N 354.362 2.636 50 40 FFGB N#C/C(=C\C=C1/C=CN(CC(N)=O)c2ccccc21)C(=O)Nc1ccccc1 2273505 MXVDRBAQYGWSFY-OTYYAQKOSA-N 370.412 2.978 50 40 FFGB O=C(COc1ccc(F)cc1F)OC(=O)COc1ccc(F)cc1F 104156282 KMXRCDPGKJHNMY-UHFFFAOYSA-N 358.243 2.771 50 40 FFGB Cc1csc(CC(=O)NNC(=O)c2ccc3c4c(cccc24)CC3)n1 14139382 SDVJLKWRHVNGFC-UHFFFAOYSA-N 351.431 2.707 50 40 FFGB C/C(=N/NC(=O)CNC(=O)c1ccc(Cl)cc1Cl)c1ccco1 4805672 YNZHPXBUFUXRMQ-OCKHKDLRSA-N 354.193 2.857 50 40 FFGB COc1cc2c(cc1/C=N/NC(=O)COc1ccc(Cl)cc1)OCO2 409051348 CLPFXWFKZLBMRH-UFWORHAWSA-N 362.769 2.606 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccc(Cl)cc1 408608718 IJOVAASHWSZDQY-SRZZPIQSSA-N 359.813 2.505 50 40 FFGB CCOc1cc(/C=N\NC(=O)Cc2ccc(OC)c(OC)c2)ccc1OC 36144891 UWYXBEPNGUIMGA-BKUYFWCQSA-N 372.421 2.804 50 40 FFGB O=C(N/N=C\c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1O 32170386 CYBSYRXBKJCCJZ-PXNMLYILSA-N 364.155 2.827 50 40 FFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)cc(OC)c1O 5051891 UIWDMJYFIMEZFS-ZDUSSCGKSA-N 370.409 2.648 50 40 FFGB COc1cc(/C=C(/C#N)C(N)=O)ccc1OCc1ccc([N+](=O)[O-])cc1 15931114 MFGQTROBLIMHCZ-ZSOIEALJSA-N 353.334 2.575 50 40 FFGB CCOC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)N(C)C)cc1Cl 59334135 UHKFDDCWHBJBNJ-WZUFQYTHSA-N 371.220 2.930 50 40 FFGB COCC(=O)Nc1cccc(CNC(=O)NNc2ccccc2Cl)c1 45730857 HGYZQJQNWZARKM-UHFFFAOYSA-N 362.817 2.751 50 40 FFGB COc1ccc(/C(C#N)=C2/Oc3cc(C#N)c(C#N)cc3N(OC)C2=O)cc1 66089266 KQVHBROKISSAJZ-KNTRCKAVSA-N 372.340 2.660 50 40 FFGB C#CCn1c(C)c(/C=N/NC(=O)CNC2CCCCC2)c2ccccc21 409384667 FAARHJGDKXJJHO-OEAKJJBVSA-N 350.466 2.955 50 40 FFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccccc1OC 408909534 UVHMMXBHTRFZBM-JPOGYNCRSA-N 369.421 2.503 50 40 FFGB O=C(N/N=C\c1cc(Br)c(N2CCCC2)o1)c1ccco1 408857320 NQEMLMLSHZDLTA-SXGWCWSVSA-N 352.188 2.999 50 40 FFGB COc1ccc(NC(=S)NNC(=O)COc2ccc(Cl)cc2)cc1 42083115 CPGSGQAAULGZFX-UHFFFAOYSA-N 365.842 2.745 50 40 FFGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc(O)cc1O 3527259 NAXFNERKLXEAPK-ODCIPOBUSA-N 353.300 2.679 50 40 FFGB Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1NC(=O)c1ccccc1 8334543 ZUKJPGCPCGJRBI-LPYMAVHISA-N 361.405 2.648 50 40 FFGB CCOC(=O)CSC1=C(C#N)C(=O)N[C@H](c2ccc(OC)cc2)S1 1240898 WOFOIZGCAFPWJD-HNNXBMFYSA-N 364.448 2.588 50 40 FFGB Cc1ccsc1/C=N/NC(=O)C(=O)Nc1ccccc1Br 59435833 GKYSFYUAVVOKQY-LZYBPNLTSA-N 366.240 2.908 50 40 FFGB CC(C)=NNC(=O)c1ccc(CN(c2ccccc2)S(C)(=O)=O)cc1 20059197 HAXWVFNCBXQWMJ-UHFFFAOYSA-N 359.451 2.778 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)NCc3ccccc3)ccc21 29657484 IFVXWAWMILGCMA-UHFFFAOYSA-N 351.410 2.509 50 40 FFGB C[C@@H]1S/C(=C(\C#N)C(=O)NCc2ccco2)N(c2ccc(F)cc2)C1=O 4295602 AUJJDEKTEYLISW-IRPICPOESA-N 371.393 2.939 50 40 FFGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)c1ccc(-n2cccc2)cc1 408962022 FPHDDZYAXVUGLA-UNOMPAQXSA-N 350.334 2.855 50 40 FFGB CC(C)(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 408996870 KFUYBDDSCFSMMB-SRZZPIQSSA-N 367.405 2.802 50 40 FFGB Cc1cccc(/C=N/NC(=O)CN(c2cccc(C)c2C)S(C)(=O)=O)c1 408921277 FQUMZBISWPJIEE-UDWIEESQSA-N 373.478 2.528 50 40 FFGB COc1ccc(SCC(=O)N/N=C\c2ccc(O)c([N+](=O)[O-])c2)cc1 408905449 YQAWDSMHHJUNRY-MFOYZWKCSA-N 361.379 2.551 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(Cl)cc2)c1 6312907 VQWYJQXZPOCYOS-WSDLNYQXSA-N 371.824 2.671 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCO2)=N\NC(=O)c1ccccc1F 100927790 JBRPOPQZCOBIKJ-SRZZPIQSSA-N 357.341 2.689 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)CCCOc2ccccc2)cc1 7639996 YAUZDAXDSWBZGL-UHFFFAOYSA-N 356.422 2.634 50 40 FFGB O=C(Cc1csc(-c2ccsc2)n1)NNC(=O)c1ccccc1O 17575833 DDIKSNSPYPJCNU-UHFFFAOYSA-N 359.432 2.581 50 40 FFGB Cc1ccc(C(=O)NNC(=O)CN2CCC(Cc3ccccc3)CC2)cc1 18708751 CHUPHGUGVCVHIK-UHFFFAOYSA-N 365.477 2.711 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc(OC)cc2O)cc(Cl)c1O 409390970 GLJHHRCHKYWSNO-DJKKODMXSA-N 364.785 2.922 50 40 FFGB Cc1cccc(OCC(=O)n2c(C)c(C(=O)NN)c3ccccc32)c1C 216725290 DAGVAFATMLKEMS-UHFFFAOYSA-N 351.406 2.889 50 40 FFGB CCS(=O)(=O)[C@H](I)C(=O)c1cccc(Cl)c1 96517945 ASXXADFKQZRWLO-JTQLQIEISA-N 372.611 2.719 50 40 FFGB CN1CCN(C(=O)/C(C#N)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 26841773 YZGIVIYSINDQHB-QINSGFPZSA-N 366.377 2.536 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)ccc1O 59444043 INJOJGDAPCRPIG-KEBDBYFISA-N 352.394 2.819 50 40 FFGB Cc1ccc(C(=O)NN=C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 1403814 KTYOKEKFIXGQBK-UHFFFAOYSA-N 371.462 2.566 50 40 FFGB CCN1C(=O)/C(=N\NC(=O)COc2cccc(Cl)c2)c2ccccc21 5791881 LGVDLZIRQHDTPB-FXBPSFAMSA-N 357.797 2.606 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)[C@@H](OC)c2ccccc2)cc1OC 685649 WZBLCWUYENZSAS-RONKMWSCSA-N 372.377 2.678 50 40 FFGB COc1ccc(/C(C)=N\NC(=O)c2cc(-c3cccn3C)n[nH]2)cc1OC 6780374 DRXXXYIFANWEJB-NDENLUEZSA-N 367.409 2.586 50 40 FFGB O=C(Cn1c(-c2ccccn2)nc2ccccc21)N/N=C/c1cccnc1 12341078 WOLYSBRJLZFNHX-YDZHTSKRSA-N 356.389 2.644 50 40 FFGB Cc1cc(C)cc(N2C(=O)C[C@@H](NNC(=O)c3cccc(Cl)c3)C2=O)c1 18222798 PFRRTGMAFGDKAG-MRXNPFEDSA-N 371.824 2.523 50 40 FFGB Cn1cccc1C(=O)NNC(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 73407494 LVEDJGUPEUODMV-NEPJUHHUSA-N 351.328 2.609 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3c(OC)cc(OC)cc3[nH]2)cc1 2239623 JINVDQXLVAQCKM-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB COc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)c([N+](=O)[O-])cc1O 9952576 GLCDUOLVNYXSPW-KPKJPENVSA-N 355.354 2.691 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2ccc(C)o2)c(Br)c1 716790 RGHLTBOKFNWQMJ-CAOOACKPSA-N 367.199 2.888 50 40 FFGB COCc1[nH]nc2c1[C@@H](c1ccc(OC(F)(F)F)cc1)C(C#N)=C(N)O2 808953 BOZKORXKMUAYSZ-LBPRGKRZSA-N 366.299 2.673 50 40 FFGB CCN(CC)C(=O)CSC1=C(C#N)[C@H](c2ccc(C)cc2)CC(=O)N1 6325181 YDYMITPAHMQRNX-HNNXBMFYSA-N 357.479 2.935 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCc3ccccc32)cc1 24748543 VCHAJIYWSGMLOI-LJQANCHMSA-N 352.434 2.895 50 40 FFGB COc1cc(/C=N/NC(=O)COc2ccc(C)cc2C)cc(OC)c1OC 3212178 QXASFAOAAPOAGN-SRZZPIQSSA-N 372.421 2.858 50 40 FFGB CCc1cccc2c(/C=N/NC(=O)Cn3nnc(-c4ccccc4)n3)c[nH]c12 6287377 GOWPBGBBAOPBBW-WSDLNYQXSA-N 373.420 2.534 50 40 FFGB CCN(CC)c1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c(OC)c1 409204598 AYMBBSWABMHOEH-FYXHJSOBSA-N 357.454 2.744 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1cc(Br)c(O)cc1O 4739580 JWBNSGRJRWXOJE-CAOOACKPSA-N 365.183 2.633 50 40 FFGB CC1=C(C#N)C(=O)N(CC(C)C)C(=O)/C1=C\Nc1ccc2c(c1)OCO2 9420298 VVSSTTQQXXROOH-NVNXTCNLSA-N 353.378 2.576 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C/N2CCN(c3ccccc3)CC2)cc1 7572354 DTKQRYHPMFWIJY-WUKNDPDISA-N 362.433 2.863 50 40 FFGB O=C(Nc1cccc(Cl)c1)[C@@H]1[C@@H]2C[C@@H]3[C@@H]1C(=O)O[C@@H]3[C@@H]2Br 8474793 IFAQTGVULZCIDC-NGFXDRFKSA-N 370.630 2.850 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1ccc(OCc2ccc3c(c2)OCO3)cc1 408853510 UUUJITJIOFGWED-SXGWCWSVSA-N 350.374 2.989 50 40 FFGB C[C@H](Nc1ccc(Br)cc1)C(=O)N/N=C1/CCCCCN1 3186174 IKAVRZGACDEXAW-NSHDSACASA-N 353.264 2.843 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc1OC 2759247 OVSQREOQVYIDBY-RGVLZGJSSA-N 356.378 2.977 50 40 FFGB O=C(Cc1nc2ccccc2[nH]1)N/N=C/c1cc(Br)ccc1O 5532432 BGUYWJRGZIEKKO-GIJQJNRQSA-N 373.210 2.724 50 40 FFGB Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NNC(=O)[C@@H]2CCCO2)c1 32260083 CDBSDMXTIJDKDK-INIZCTEOSA-N 361.829 2.688 50 40 FFGB COc1ccc(CCNC(=O)/C(C#N)=C/c2ccc(C#N)cc2)cc1OC 6897675 RLWPDCBKOHAVFK-WOJGMQOQSA-N 361.401 2.841 50 40 FFGB Cc1nc(N)nc(O)c1CCCNc1ccc(/C=C\C(=O)CCl)cc1 8627121 VOULAGCYJDNJNZ-TWGQIWQCSA-N 360.845 2.939 50 40 FFGB CC(C)N1C(=O)/C(=N\NC(=O)c2ccccc2O)c2cc(Cl)ccc21 9871562 DFNCFNUBRFNSMV-SILNSSARSA-N 357.797 2.935 50 40 FFGB C[C@@H](SCc1ccccc1)C(=O)N/N=C1/C(=O)N(C)c2ccccc21 103727399 GGQYFDRNGLHAML-HZDTVXMRSA-N 353.447 2.805 50 40 FFGB O=C(Cc1cn2ccsc2n1)NNC(=O)[C@H]1C[C@H]1c1ccccc1Cl 9337154 MDRJMFGIQHUJAE-STQMWFEESA-N 374.853 2.543 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)COc2ccccc2C)cc1OC 408830939 OWVFVPJMJWCWIL-RGVLZGJSSA-N 372.377 2.678 50 40 FFGB Cn1nc(C(F)(F)F)c([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)c1Cl 253406964 VJGJVRSSNFGETH-VIFPVBQESA-N 372.734 2.907 50 40 FFGB C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1nc2ccccc2s1 105557075 DHXGCTYGPMGXLN-PZUDMAOCSA-N 353.403 2.977 50 40 FFGB COC(=O)COc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1 408849040 XUILDSLRPRGZPA-JAIQZWGSSA-N 352.346 2.749 50 40 FFGB Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1ccccc1C(=O)O 6266150 GIRHUQSNGMHLGI-WSDLNYQXSA-N 362.389 2.951 50 40 FFGB COc1ccccc1[C@H]1[C@H](C(=O)C2CC2)N2C=C(C#N)C=C[C@@H]2C1(C#N)C#N 4729604 VTGZRMNOOGIDGF-HSALFYBXSA-N 370.412 2.822 50 40 FFGB O=C(N/N=C/c1cccc(O)c1)c1cccc(I)c1 59508265 JBRBVURGFCKQFG-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB Cc1ccc(/C=N/NC(=O)c2ccc(NC(=O)CCC(=O)O)cc2)cc1 1085631 BCOBICWYEQFYKX-UDWIEESQSA-N 353.378 2.562 50 40 FFGB COc1ccc(CC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1 5481558 AAHVBBGZPCPLCC-UHFFFAOYSA-N 370.449 2.762 50 40 FFGB CCOC(=O)c1c(NC(=O)CCl)sc(C(=O)N(CC)CC)c1C 3267925 PCRXEXGNEIGAEW-UHFFFAOYSA-N 360.863 2.893 50 40 FFGB Cc1nn(-c2ccccc2)c(O)c1/C(=N\NC(=O)C1CC1)C(F)(F)F 408956268 QGJBHFBPUQRRKL-DEDYPNTBSA-N 352.316 2.679 50 40 FFGB O=C(O)[C@@H](Br)[C@@H](Br)c1cccc([N+](=O)[O-])c1 6220958 AYUJMWVMPDGXFF-YUMQZZPRSA-N 352.966 2.879 50 40 FFGB COc1cc(/C=N\NC(=O)Cc2cc(C)ccc2C)c(O)c([N+](=O)[O-])c1 409361551 HPJXOHGODJRVDC-GRSHGNNSSA-N 357.366 2.619 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2nc3ccccn3c2C)cc1OC 4863953 CVYXCWIDWFPKOO-CIAFOILYSA-N 352.394 2.814 50 40 FFGB C/C(=N\NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C)c1ccc(Cl)s1 5215713 RXFOPBVPAHVBTN-VIZOYTHASA-N 355.807 2.663 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(Br)cc1 1497071 AQMYZGPNWIBLQY-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB Cc1c(C)[n+](=O)c2c(n1O)[C@@H](Br)CC[C@H]2Br 104096697 PLANLDNZPQGAQC-JGVFFNPUSA-N 353.034 2.923 50 40 FFGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1cccnc1 2324055 SHZPOQMEYFAGOU-SECBINFHSA-N 354.193 2.617 50 40 FFGB CCOc1ccc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c(O)c1 13847817 WQXDHAPYRKONGC-VXLYETTFSA-N 373.365 2.537 50 40 FFGB O=C(NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCC2)c1ccco1 14139299 GYRXILYQTWIRLO-UHFFFAOYSA-N 368.368 2.558 50 40 FFGB COc1ccnc(NNC(=O)c2cnn(Cc3ccccc3)c2C(C)C)n1 32168317 HUPCHEQDZSYTCH-UHFFFAOYSA-N 366.425 2.610 50 40 FFGB C[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1cccc(Br)c1 3148177 XDEIDXZSWLIWGC-MKFNJMOCSA-N 374.238 2.718 50 40 FFGB COCc1cc(C)nc(OCC(=O)N/N=C/C=C/c2ccccc2)c1C#N 2186655 FAGWVZCLCIWUED-MIUOOWFYSA-N 364.405 2.602 50 40 FFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 12807395 WCIYVOGYJXLVRN-KRWDZBQOSA-N 354.406 2.585 50 40 FFGB O=C(N/N=C/c1cccs1)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 1091901 SMHKVMMEEWHDRZ-LICLKQGHSA-N 355.379 2.665 50 40 FFGB CC[C@@H](Oc1ccc(C)cc1)C(=O)NNC(=O)Cc1ccc(OC)cc1 12137421 SXPWJYPYAZSXBL-GOSISDBHSA-N 356.422 2.551 50 40 FFGB NC(=O)COc1ccc(Cl)cc1/C=N\NC(=O)c1ccc(Cl)cc1 409260189 MFNALTZVRRHCFB-ZBKNUEDVSA-N 366.204 2.621 50 40 FFGB CCc1nnc2sc(SSc3nn4c(CC)nnc4s3)nn12 27027683 DOILVVIJAALYHL-UHFFFAOYSA-N 370.514 2.609 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc(OC)c1O 408543469 RISYTQZLPGRIMH-MLPAPPSSSA-N 368.345 2.653 50 40 FFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@H]1c1ccc(OCC)c(OC)c1 57509069 RCOIGSZCRMASQA-HNNXBMFYSA-N 368.817 2.504 50 40 FFGB CCO/C=N/C1=C(C#N)SC2=N/C(=C\c3ccc(OC)cc3)C(=O)N21 104316374 QWXSUNLIDKDWMQ-KGIYGKSBSA-N 354.391 2.739 50 40 FFGB Cc1ccccc1NC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br 408691285 ZFNUKQJPJNMCBQ-OEXQXWKBSA-N 350.212 2.505 50 40 FFGB C/C(=N/NC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 5516801 HYXBHTJXSCGDPQ-MOSHPQCFSA-N 354.366 2.854 50 40 FFGB C/C(Cn1nnc2ccccc21)=N\NC(=O)c1ccc(Br)cc1 12362473 LSDUBEVQVZCJOU-WOJGMQOQSA-N 372.226 3.000 50 40 FFGB C/C(CC(=O)NC1CCCC1)=N\NC(=O)c1ccc([N+](=O)[O-])cc1Cl 100055349 SSRNZCRRXNCNRH-VXLYETTFSA-N 366.805 2.803 50 40 FFGB C[C@H](Oc1cccc2cccnc12)C(=O)N/N=C/c1ccc2c(c1)OCO2 716820 TWIOQZWYENBSIJ-YSRRJJCPSA-N 363.373 2.881 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCCO3)ccc1O 3448581 DRUSKVIIYLGISF-MDWZMJQESA-N 352.346 2.718 50 40 FFGB CC(=O)Oc1ccccc1C(=O)[C@@H](Br)CBr 309325650 QTKUYINVVVRXAG-VIFPVBQESA-N 350.006 2.953 50 40 FFGB CCc1ccccc1N(CC(=O)N/N=C(\C)C(C)(C)C)S(C)(=O)=O 408785851 IOHZPHJBCSAZEB-QGOAFFKASA-N 353.488 2.553 50 40 FFGB N#Cc1ccccc1COc1ccc(/C=N/NC(N)=O)cc1Br 6222398 LPRMNHQTCXRPMX-AWQFTUOYSA-N 373.210 2.902 50 40 FFGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(OCC)cc2)cc1OC 20764645 YKHLLUQJHFYOOM-KGENOOAVSA-N 352.390 2.870 50 40 FFGB O=C(N/N=C/c1cccnc1)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 409007757 ZIKWJLOVAJPPNV-LPYMAVHISA-N 370.840 2.738 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(OC3CSC3)cc2)cc1OC 408862641 HFKQZNBLKOVKRN-KEBDBYFISA-N 372.446 2.962 50 40 FFGB O=C(NNC(=S)NC12CC3CC(CC(C3)C1)C2)c1ccc([N+](=O)[O-])cc1 5601512 UJHBADHHLOALRV-UHFFFAOYSA-N 374.466 2.673 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1cccn1-c1cccc(C(=O)O)c1 409108823 WHVLAAHLRDVBDJ-FYJGNVAPSA-N 363.373 2.948 50 40 FFGB N#C/C(=C\c1cccc(Br)n1)C(=O)N[C@@H](N)c1ccccc1 98175554 MQTRVLDBPTZTMJ-SAAWKEMMSA-N 357.211 2.525 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccn2)cc1[N+](=O)[O-] 5130150 BSERZKNESHYTIN-VDCVXVNISA-N 360.395 2.629 50 40 FFGB COc1ccc(CC(=O)N/N=C/c2cc(Br)ccc2O)cc1 5916989 NMVFFSWSVIOIMR-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc3c(c2)OCO3)cc1 100796585 CARSLWJWOJDNHY-CIAFOILYSA-N 369.377 2.558 50 40 FFGB COc1ccccc1NC(=O)COc1ccc(/C=C(/C#N)C(N)=S)cc1 107875428 JZHIQDVMISUBBN-UVTDQMKNSA-N 367.430 2.906 50 40 FFGB CCOC(=O)c1[nH]c(C)c(C(=O)N/N=C/C=C/c2ccc([N+](=O)[O-])o2)c1C 3664196 ZFOSHXYFTQKJQT-LTIZGNAXSA-N 374.353 2.738 50 40 FFGB CC1=C(C(=O)OCCCCl)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 3899937 FNGKFCAHSARMIN-OAHLLOKOSA-N 351.834 2.553 50 40 FFGB CCOC(=O)c1ccc(-c2ccc(/C=N\NC(=O)c3cnccn3)o2)cc1 67194093 PJKPAZBCOANAKW-JJFYIABZSA-N 364.361 2.677 50 40 FFGB Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c(C)n1Cc1ccco1 7159950 NTORPAPHRQGHGT-LTXFRBGYSA-N 353.422 2.948 50 40 FFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1ccc(Br)cc1 409043942 BKMHXPIKKYYRBA-GIJQJNRQSA-N 361.195 2.871 50 40 FFGB CCOc1cc2c(cc1/C=N\NC(=O)CNc1ccc(C)c(C)c1)OCO2 409087768 HPBZVFZEHUEZQJ-YVNNLAQVSA-N 369.421 2.993 50 40 FFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccccc1OC 408909532 UVHMMXBHTRFZBM-AQRZYSDFSA-N 369.421 2.503 50 40 FFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3cccs3)CC2)c1 1103062 DGUFPBSRGBAQDD-DEDYPNTBSA-N 371.462 2.759 50 40 FFGB N#C/C(=C\c1cccnc1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 2708580 LYRNQDYGAQPHPF-XYOKQWHBSA-N 352.419 2.666 50 40 FFGB CCOc1cc(/C=N\NC(=O)Cc2ccc(OC)c(OC)c2)ccc1O 59515925 ISPHWTNOJHVTFM-NDENLUEZSA-N 358.394 2.501 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1ccccc1OC(F)F 8830393 KGVIKUARMBDUOZ-UHFFFAOYSA-N 351.378 2.597 50 40 FFGB Cc1nc(Sc2ccc(/C=N/NC(=O)c3ccco3)cc2[N+](=O)[O-])n[nH]1 409192688 FFNZAEQAZAEDNM-LZYBPNLTSA-N 372.366 2.529 50 40 FFGB CCO[Si](CCCNC(=O)c1ccc([N+](=O)[O-])cc1)(OCC)OCC 169898500 NMWDYCNYWCIATE-UHFFFAOYSA-N 370.478 2.763 50 40 FFGB C/C(CC(=O)Nc1ccc(F)cc1)=N\NC(=O)c1cccc([N+](=O)[O-])c1 100034871 ZJUJLRXCCHUICY-RGVLZGJSSA-N 358.329 2.868 50 40 FFGB COc1cc(/C=N\NC(=O)c2cc(-c3ccc(C)s3)n[nH]2)ccc1O 34629381 IRJJPTMFSPYUMC-NVMNQCDNSA-N 356.407 2.925 50 40 FFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1ccccc1C(F)(F)F 675979 XWILWLODOBFXON-UFFVCSGVSA-N 374.326 2.509 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cccc(OC)c2OC)cc1 33677033 WETHLXVRTCYMEM-WJDWOHSUSA-N 352.390 2.936 50 40 FFGB COc1cccc(/C=N\NC(=O)CSc2nc3ccccc3o2)c1O 32519874 DMTYWBOXTPQNBL-NVMNQCDNSA-N 357.391 2.784 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(C(=O)O)cc2)cc1 223173660 XCBQOXPNCCVWPD-GDNBJRDFSA-N 350.330 2.717 50 40 FFGB O=C(Cn1cc(C(F)(F)F)ccc1=O)N/N=C/c1ccc(Cl)cc1 3186653 HHIVYAAEHBXHTJ-IFRROFPPSA-N 357.719 2.671 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc(-c3cccs3)n[nH]2)c(OC)c1 6564951 NNWXDRKHOSVUGY-VCHYOVAHSA-N 356.407 2.919 50 40 FFGB O=C(C[C@@H]1C[C@@H]2CC[C@@H]1C2)NNC(=O)c1cncn1-c1ccc(F)cc1 103014983 MNPYEKOXSVGOQB-MCIONIFRSA-N 356.401 2.599 50 40 FFGB CN1CCC(=NNC(=O)C(=O)Nc2ccc(Oc3ccccc3)cc2)CC1 58885799 LYZYXXBWLBSQLV-UHFFFAOYSA-N 366.421 2.615 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccc4c(c3)OCO4)c2[C@H]1c1ccc(O)cc1 6188195 QDIYNLUMYXOLLL-INIZCTEOSA-N 374.356 2.729 50 40 FFGB CCCCC(=O)NN/C(CC)=C1/C(=O)N(c2ccccc2C)C(=O)N=C1O 16956655 DCJIXKHOVTZOCW-DTQAZKPQSA-N 372.425 2.893 50 40 FFGB O=C(O)CC/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 17073434 XZFHULYSAMNBSJ-KNTRCKAVSA-N 355.350 2.523 50 40 FFGB COC(=O)C1=C[C@H](Br)CCN1C(=O)OCc1ccccc1 217466787 VYXUDLMDPOUTKA-GFCCVEGCSA-N 354.200 2.849 50 40 FFGB O=C(NNC(=O)c1cc2c(s1)CCC2)c1ccc2nc3n(c2c1)CCC3 32936128 DTRFXXUMPGFZCR-UHFFFAOYSA-N 366.446 2.608 50 40 FFGB CCS(=O)(=O)[C@@H](I)[C@H](O)c1ccc(Cl)cc1 96519253 ZHTHAKSDTTVRCG-NXEZZACHSA-N 374.627 2.569 50 40 FFGB O=C(COc1ccc(Oc2ccccc2)cc1)NNC(=O)c1cccnc1 12937813 YQZUXWXBAIDGRW-UHFFFAOYSA-N 363.373 2.714 50 40 FFGB NNC(=O)c1cc(Cl)c(OCc2cccnc2)c(Br)c1 226340610 LCGMHLFJVDOPSM-UHFFFAOYSA-N 356.607 2.680 50 40 FFGB C[C@@H](NC(=O)C(=O)N/N=C/c1cccc(Br)c1)c1ccccc1 3147933 USEAHTSGJONCJL-ZGXHQARYSA-N 374.238 2.777 50 40 FFGB O=C(C[C@@H]1C[C@H]2CC[C@@H]1C2)NNC(=O)c1cncn1-c1ccc(F)cc1 8294279 MNPYEKOXSVGOQB-MJBXVCDLSA-N 356.401 2.599 50 40 FFGB C/C(=N/NC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1)c1cccc(O)c1 4678017 GJLAOYDFVJKKSQ-ODLFYWEKSA-N 365.349 2.845 50 40 FFGB CNC(=O)/C(C#N)=C/c1ccc(OCC(=O)N[C@H](C)c2ccccc2)cc1 408792222 JRGCLBXGMSGLMD-GYZOOYGHSA-N 363.417 2.596 50 40 FFGB O=C(Cc1cc(Cl)c2c(c1)OCCO2)NNCc1cc(F)ccc1F 84344186 RBCFCVWSLJKPIR-UHFFFAOYSA-N 368.767 2.753 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1cc(Br)cc(Br)c1O 408853157 YULXSBKVDVFMBK-BAQGIRSFSA-N 374.032 2.912 50 40 FFGB CCc1ccc(NC(=O)[C@@H]2[C@H]3C[C@H]4[C@H](OC(=O)[C@@H]24)[C@@H]3Br)cc1 408677510 BZUUVJPOVIVQMP-OJVARPOJSA-N 364.239 2.759 50 40 FFGB O=C(COc1ccccc1Cl)NNC(=O)CSc1ccccc1 5064033 PUTCOKSWNSHXIC-UHFFFAOYSA-N 350.827 2.659 50 40 FFGB Cc1cc(C)c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c(C)c1 7032865 AVPKRHOSKLSFFV-UHFFFAOYSA-N 374.824 2.883 50 40 FFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccc(OCC)cc2)CC(=O)N1 9110530 WEVSSVOXEUHILZ-CQSZACIVSA-N 360.435 2.720 50 40 FFGB Cc1cc(Br)c2c(c1)/C(=N/NC(=O)c1ccc(O)cc1)C(=O)N2 5093714 MGQUXXZMWDPGNJ-UHFFFAOYSA-N 374.194 2.549 50 40 FFGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@H]2c1ccc(O)c(OC)c1 5267124 HGTVGJWXHDLNFG-AWEZNQCLSA-N 372.402 2.776 50 40 FFGB COC(=O)N/N=C/c1cccc(OCCOc2ccc([N+](=O)[O-])cc2)c1 4525982 LXJYMRZQEQJFRI-LDADJPATSA-N 359.338 2.743 50 40 FFGB COCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(C(C)C)cc2)C1=O 9423885 JJXVTMAJUOVEAE-PDGQHHTCSA-N 353.422 2.961 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2OCC#N)cc1 408799606 ZXADCURIFIFPJC-FOWTUZBSSA-N 361.357 2.921 50 40 FFGB COc1ccc(/C(C)=N\NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC 33756812 NYLLAHRVBCDDAI-UNOMPAQXSA-N 357.366 2.695 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N\NC(=O)Cc1ccc(C)cc1C 216046477 JOKRJTLITBDCOX-JAIQZWGSSA-N 371.393 2.922 50 40 FFGB NNC(=O)c1cccn1-c1cc(Br)ccc1Br 223744687 JRRGNUKUOBDESE-UHFFFAOYSA-N 359.021 2.606 50 40 FFGB Cc1cc(OCC(=O)NNC(=O)C2CCCCC2)ccc1Br 5925203 VKBFZYIZGOGPHX-UHFFFAOYSA-N 369.259 2.864 50 40 FFGB COC(=O)/C(=N/NC(=O)c1ccccc1O)[C@@H](C#N)c1ccc(Cl)cc1 17197171 RUMLQRVPIXXRHO-IKBYJFNHSA-N 371.780 2.612 50 40 FFGB C/C(CC(=O)C(F)(F)C(F)(F)C(F)(F)F)=N/NC(=O)c1cccnc1 101156182 YIVSRKLQAYETKV-HOEBFWFUSA-N 373.228 2.979 50 40 FFGB O=C(CN1CCCc2ccccc21)NNC(=O)Nc1ccc(Cl)cc1 3192770 YJAYHULTKLEFOP-UHFFFAOYSA-N 358.829 2.946 50 40 FFGB N#CC(C#N)=CNCc1ccc(NC(=O)CN2CCc3ccccc32)cc1 55008274 UUCYLGSILVAIPX-UHFFFAOYSA-N 357.417 2.708 50 40 FFGB Cc1ccccc1C[C@@H]1S/C(=C(/C#N)C(N)=O)N(c2ccccc2)C1=O 2376703 WTIFUCLUFDINKP-IMGOXIFKSA-N 363.442 2.907 50 40 FFGB C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12 14229514 YOCCCADDIPCNDL-LBPRGKRZSA-N 371.824 2.979 50 40 FFGB C=CCN1C(=O)/C(=N/NC(=O)COc2cc(C)ccc2C)c2ccccc21 9434435 UXRGNEMNUTZKHE-BSYVCWPDSA-N 363.417 2.735 50 40 FFGB COc1cc(OC)c(/C=C(/C#N)C(=O)NC(C)C)cc1Br 408784570 UZGVCMNQBSAQLD-WZUFQYTHSA-N 353.216 2.898 50 40 FFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc([N+](=O)[O-])o1)c1ccccc1 409000562 XLZITESHRJJUQV-XWAFYUISSA-N 374.353 2.515 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)cc(C)c2)cc1 408971607 KBLJXGVVUIOAJL-FYJGNVAPSA-N 351.406 2.957 50 40 FFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccc(C(C)C)cc2)cc1 223156957 KUPDMIMSZCZEAK-MTJSOVHGSA-N 367.405 2.685 50 40 FFGB C=CCN1C(=O)/C(=N/NC(=O)COc2cccc(C)c2C)c2ccccc21 4549118 MSPSTPHRPFYROL-BSYVCWPDSA-N 363.417 2.735 50 40 FFGB Cc1ccc(N2C(=O)[C@H]3SC(N)=C(C#N)[C@H](c4ccco4)[C@@H]3C2=O)cc1 1424688 GHPDSTAHLAOERL-PMPSAXMXSA-N 365.414 2.671 50 40 FFGB Cn1cc(C(=O)NNC(=O)c2ccc(-c3cnco3)cc2)c2ccccc21 54147445 DQRVQPBLYFXXNG-UHFFFAOYSA-N 360.373 2.908 50 40 FFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1cccc(O)c1)c1ccccc1 408976229 ABIQKJXGUOQAES-UOBPLZBXSA-N 355.394 2.720 50 40 FFGB COc1ccccc1NCC(=O)N/N=C1/C(=O)Nc2ccc(C(C)C)cc21 6146361 YBXKYSQXLYRGTF-UHFFFAOYSA-N 366.421 2.703 50 40 FFGB CCCCCCOc1ccc(/C=C/C(=O)NNC(N)=S)cc1OC 62714601 GLFDHOSBJOYVCS-CSKARUKUSA-N 351.472 2.532 50 40 FFGB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@H]1C[C@H]1c1ccccc1 4729467 XQCBUEOBLUJVME-BAMWUGHESA-N 351.362 2.559 50 40 FFGB Cc1ccccc1C(=O)N/N=C/c1ccc(OCC(=O)NC(C)C)cc1 28215266 GUFIIAGIPIWMIF-CIAFOILYSA-N 353.422 2.662 50 40 FFGB C/C(=N\NC(=O)CSc1nc2ccccc2n1C)c1ccc(O)cc1 18136458 YIBFOOPJEIIJTB-UDWIEESQSA-N 354.435 2.911 50 40 FFGB NC(=O)CCn1cc(/C=N/NC(=O)CCc2ccccc2)c2ccccc21 14134451 BXLVBUBONOZLGK-OEAKJJBVSA-N 362.433 2.600 50 40 FFGB CC(=O)/C(C#N)=C1/NC(=O)[C@@H](Cc2ccc(Br)cc2)S1 13687702 GZAPPVNNNJMCJQ-POKNLVKOSA-N 351.225 2.547 50 40 FFGB CCOc1ccc(N[C@@H](C)C(=O)N/N=C/c2ccc(O)c(OC)c2)cc1 695565 MJUNAHFLQRZUTD-DZUMZMOTSA-N 357.410 2.750 50 40 FFGB O=C(C[C@@H](C(=O)O)c1ccccc1)NNC(=O)C12CC3CC(CC(C3)C1)C2 16481012 HZRRJFGMIJRMDY-BFKIHDCISA-N 370.449 2.609 50 40 FFGB CCOc1cc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)ccc1OC 409044842 DRDIVSYELWTIKD-RGVLZGJSSA-N 356.378 2.515 50 40 FFGB COC(=O)c1ccccc1NC(=O)C/C(C)=N/NC(=O)Cc1cccs1 101960361 KOTUSZMIXPYADH-UDWIEESQSA-N 373.434 2.598 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc1OC 21963957 BXKYVVAIAYFPMQ-XDHOZWIPSA-N 373.365 2.531 50 40 FFGB O=C(N/N=C/c1sc(=O)n(-c2ccccc2)c1Cl)c1ccncc1 1254759 XWQDHZLVYYVOOM-VXLYETTFSA-N 358.810 2.711 50 40 FFGB O=C(CCCSc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1 3430446 PWJCJAQBSBEFDW-QGZVFWFLSA-N 372.446 2.546 50 40 FFGB Cc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c(C)n1Cc1ccco1 7159953 NTORPAPHRQGHGT-WAFWZSCLSA-N 353.422 2.948 50 40 FFGB CCOc1ncccc1CNC(=O)NNC(=O)c1oc2ccccc2c1C 12546063 YNDOYNUWUKHBLD-UHFFFAOYSA-N 368.393 2.679 50 40 FFGB CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)[C@@H](C)Cl 3887975 ALZZKNXHCOMPGP-GFCCVEGCSA-N 356.850 2.886 50 40 FFGB in-vitro C/C(=N\NC(=O)c1ccc(CN2CCOCC2)cc1)c1ccc(C)cc1 18173196 PIVKKZQMBUYINX-OQKWZONESA-N 351.450 2.981 50 40 FFGB Cn1cc(/C=N/NC(=O)CN2C[C@H](c3ccccc3)CC2=O)c2ccccc21 408977599 XLIJCHODQMDSNE-UXHMZNKVSA-N 374.444 2.645 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@H]1c1ccc([N+](=O)[O-])cc1 100201056 IKFJDPLWPZJNGD-HNNXBMFYSA-N 373.324 2.736 50 40 FFGB CCOC(=O)NNC(=O)c1ccc(OCc2cn3cc(C)ccc3n2)cc1 39547656 MVUOPXJYHCINEX-UHFFFAOYSA-N 368.393 2.613 50 40 FFGB COC(=O)c1c(NC(=S)NNC(C)=O)sc2c1CCCCCC2 6317909 NPXXIFLWISUIKZ-UHFFFAOYSA-N 355.485 2.531 50 40 FFGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccccc1[N+](=O)[O-] 408761815 HSXXHXIMXJEXHW-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CCCCN1C(=O)/C(=N\NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 100175861 HVDCSOJOSPFVCE-JZJYNLBNSA-N 366.377 2.876 50 40 FFGB COc1ccc2nc(/C=N/NC(=O)[C@H](C)NC(=O)OC(C)(C)C)ccc2c1 2336274 GHVIJXUCZKWOGA-DQAKUKQTSA-N 372.425 2.607 50 40 FFGB CCN(NC(=O)CCN1C(=O)COc2ccccc21)c1ccc(C)cc1 8052028 APAIGMSNWVVBQF-UHFFFAOYSA-N 353.422 2.668 50 40 FFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(N(C)C)cc2)c1C 18102889 UTFQURBNFZFSEZ-OAHLLOKOSA-N 355.438 2.598 50 40 FFGB COc1cccc(/C=N\NC(=O)Nc2ccccc2)c1O[C@@H](C)C(=O)O 409234954 BIQUEDQGYFQCFP-XHEYCZLTSA-N 357.366 2.703 50 40 FFGB COC(=O)[C@@H](CNC(=O)[C@@H](C)Br)Cc1ccc(Cl)cc1 95097986 AVRVVAQZADXCHM-MWLCHTKSSA-N 362.651 2.571 50 40 FFGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1ccccc1C(=O)O 5634696 XLYJBAPYFJTIRE-UFWORHAWSA-N 356.769 2.758 50 40 FFGB Cc1ccc(-n2ncc3c(NNC(=O)c4cccs4)ncnc32)cc1 4355195 CICMKCNAKVUYEZ-UHFFFAOYSA-N 350.407 2.942 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)c2ccccc2)c2cc(Br)ccc21 6496959 WRZRYPSWXOWZPU-XDJHFCHBSA-N 372.222 2.950 50 40 FFGB C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccccc1 8242583 CHXJQGHZQCSTJD-LLVKDONJSA-N 363.211 2.678 50 40 FFGB C[C@H](Br)C(=O)NC[C@H](O[C@H]1CCOC1)c1cccc(F)c1 109912911 VHPHYPYBRHIIEX-BPNCWPANSA-N 360.223 2.572 50 40 FFGB O=C(NNC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccco1 17441137 NGSWJWXHFBGZGP-UHFFFAOYSA-N 358.357 2.965 50 40 FFGB CC1(C)[C@]2(C)CC[C@]1(C(=O)NCC(F)(F)F)[C@H](Br)C2=O 100748364 XPYVXBMOLCPOGB-NZXMKCKXSA-N 356.182 2.824 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 408771599 JPHDUNJQDKOZLD-GIJQJNRQSA-N 361.741 2.799 50 40 FFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(OC)cc3)CC2=O)cc1 409249954 KHVNKNJPQQLMOT-VYZAVGSRSA-N 365.433 2.761 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2)ccc1O[C@@H](C)C(=O)O 409011362 HHURFUDLBYNKBY-HSWQHBDASA-N 356.378 2.619 50 40 FFGB O=C(N/N=C/c1ccccc1F)C1CCN(C(=O)c2ccc(F)cc2)CC1 409006052 LLNUWQCWNUQSKE-YDZHTSKRSA-N 371.387 2.967 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)ccc1OC 33764314 TWQCIZAXFUQYPO-UDWIEESQSA-N 355.394 2.816 50 40 FFGB CCc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 3211930 KFMQXVBUGXPXBR-CIAFOILYSA-N 367.405 2.847 50 40 FFGB COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1 803666 OBNOZLLSAKMJIT-MRXNPFEDSA-N 374.352 2.798 50 40 FFGB C/C(=N\NC(=O)CSc1nc2ccccc2n1C)c1ccccc1O 100267256 KARRSQGOQZAMJL-UDWIEESQSA-N 354.435 2.911 50 40 FFGB CCOc1ccc(-c2cc(C(=O)N/N=C/c3ccco3)[nH]n2)cc1OC 4677634 BTERSNQHGJFKHJ-YBFXNURJSA-N 354.366 2.841 50 40 FFGB Cc1cc(O)cc(O)c1/C=N/NC(=O)Cc1ccc(Br)cc1 4735304 VHQDZXHHNQAHLH-GIJQJNRQSA-N 363.211 2.862 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)cc1 408969193 IWPBWTLJTGAJEB-RGVLZGJSSA-N 352.346 2.992 50 40 FFGB O=C(N/N=C/c1ccncc1)C1CCN(C(=O)c2ccccc2Cl)CC1 409006916 SNITXMIOMYANDE-LPYMAVHISA-N 370.840 2.738 50 40 FFGB C/C(=N/NC(=O)Cc1nc2sc(C)c(C)c2c(=O)[nH]1)c1cccc(F)c1 48278609 DJBCOAZRXARHBX-YVNNLAQVSA-N 372.425 2.823 50 40 FFGB O=C(N/N=C1\CCSc2ccc(Br)cc21)[C@@H]1CCCO1 63383110 LITOFFRBSUJCSU-JASJWYONSA-N 355.257 2.944 50 40 FFGB O=C(NN=C1CSc2sc(=O)sc2SC1)c1ccncc1 4535478 XASXGXZKFYGBNG-UHFFFAOYSA-N 355.491 2.549 50 40 FFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1O 999229 MCWRMECNDQINIF-UHFFFAOYSA-N 355.177 2.539 50 40 FFGB N#C/C(N)=C(C#N)/N=C/c1cc([N+](=O)[O-])ccc1Sc1ccccn1 33701059 MYKQUDVIHUCYSL-UBRDFSTESA-N 350.363 2.777 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1ccccc1F 100522739 ZSMJWLAFAZSYFE-WSDLNYQXSA-N 371.368 2.731 50 40 FFGB CCCCn1c(CCl)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 6161698 MFLDBELZWSXRTM-UHFFFAOYSA-N 371.890 2.596 50 40 FFGB O=C(CSc1cccc2cccnc12)N/N=C1/C(=O)Nc2ccccc21 17952239 IYZZXYPVGJPREX-UHFFFAOYSA-N 362.414 2.800 50 40 FFGB C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1 3431295 FLVIPETUBIXORZ-COGMNKOPSA-N 369.465 2.992 50 40 FFGB N#C/C(=C\c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)NC[C@@H]1CCCO1 4525018 JBUXZQQMDPGZLM-OBHPCNEJSA-N 366.373 2.847 50 40 FFGB O=C(Cn1ccc(C(F)(F)F)n1)N/N=C/c1c(O)ccc2ccccc12 3226750 XJSGFHNILLIKOL-ZVBGSRNCSA-N 362.311 2.911 50 40 FFGB COc1cccc(/C=C/C(=O)NNC(=O)c2cc(Cl)ccc2OC)c1 3547494 PWPGDBRDCQRUGI-RMKNXTFCSA-N 360.797 2.832 50 40 FFGB CS(=O)(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccncc1 96891422 ZJQPSZNTRJWPSZ-BOPFTXTBSA-N 350.403 2.843 50 40 FFGB CC[C@H](C)C(=O)NNC(=O)C1(c2cccc(C(F)(F)F)c2)CCOCC1 71921872 DMYHXKXVWOYUII-LBPRGKRZSA-N 372.387 2.947 50 40 FFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc([N+](=O)[O-])o1)c1ccccc1 409000559 XLZITESHRJJUQV-BGARDKSCSA-N 374.353 2.515 50 40 FFGB O=C(CSc1nc2ccccc2o1)N/N=C/c1ccc([N+](=O)[O-])cc1 716832 PJBLDGRQOZOQIV-RQZCQDPDSA-N 356.363 2.978 50 40 FFGB O=C(N/N=C/c1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1 58885115 GLYAWSPNXAAMRJ-UDWIEESQSA-N 362.345 2.837 50 40 FFGB C/C(CC(=O)NCCc1ccccc1)=N/NC(=O)COc1ccccc1C 102784933 NWPHKDCTLFPIIH-QJOMJCCJSA-N 367.449 2.615 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)COc2ccccc2C)cc1OCC 10000973 ACJMRCMRDHTJTM-UHFFFAOYSA-N 372.421 2.632 50 40 FFGB Cc1ccc2[nH]c(SCC(=O)NNC(=O)c3ccc(F)cc3)nc2c1 6567117 MZVJHOKHNUIJKW-UHFFFAOYSA-N 358.398 2.564 50 40 FFGB CC(C)c1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1C(C)(C)C 40140072 RDQCGNBXODERBY-UHFFFAOYSA-N 373.413 2.745 50 40 FFGB O=C(NN=C1CCN(Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 57211634 SHQCUAYHDCHFOL-UHFFFAOYSA-N 352.394 2.977 50 40 FFGB CCCCC(O)(CCCC)C(=O)N/N=C1\C(=O)N(CC)c2ccccc21 18192914 ZBZXAKYRDISHQP-FXBPSFAMSA-N 359.470 2.985 50 40 FFGB C/C(=N\NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O)c1ccccc1 19955406 VXHBYMKCKDSFSR-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@H](c1cccs1)C(C#N)=C(N)O2 1263962 HEIMWOLXZMZGBF-WBMJQRKESA-N 369.446 2.615 50 40 FFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccnc(NC2CC2)c1 65519456 WFJUGPSRMRSFLL-UHFFFAOYSA-N 354.454 2.633 50 40 FFGB CC1=C(C(=O)Nc2ccccc2C)[C@H](c2cccnc2)N2NC=C(C#N)C2=N1 9423054 XVYDLFAHMUUYCM-IBGZPJMESA-N 370.416 2.984 50 40 FFGB COc1ccccc1/C=N/NC(=O)C1CCN(C(=O)c2ccccc2)CC1 409006674 QRPAJBXURJPIFC-PXLXIMEGSA-N 365.433 2.698 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)Nc2cc(C)cc(C)c2)c1 408971516 HIAXTSHYZCPLEP-FYJGNVAPSA-N 351.406 2.957 50 40 FFGB O=C(N/N=C/c1ccc(N2CCOCC2)o1)c1cc2ccccc2cc1O 1029432 SMSVZIIQDOPCGC-FYJGNVAPSA-N 365.389 2.739 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2cc(Br)c(C)o2)cc1 3150963 QIQLDPJSZXEHBH-CAOOACKPSA-N 367.199 2.888 50 40 FFGB COc1ccc(NC(=S)NNC(=O)COc2cccc(Cl)c2)cc1 59449426 WHKJOCUUDNYSPZ-UHFFFAOYSA-N 365.842 2.745 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2ccc(OC)cc2)cc1 3398132 OVLNHWWHMUPZHG-PTNGSMBKSA-N 366.373 2.793 50 40 FFGB C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1OCC 6196142 DNYSVOHRGXPDMN-QGZVFWFLSA-N 352.394 2.900 50 40 FFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc([N+](=O)[O-])cc1 20248294 MGCOTDVTLQQCBP-RQZCQDPDSA-N 374.378 2.887 50 40 FFGB CCn1c(=O)c(C(=O)N/N=C/c2cccc(F)c2)c(O)c2ccccc21 100534726 WTMLFVKIXFOYQA-SRZZPIQSSA-N 353.353 2.630 50 40 FFGB CC1(C)C(=O)[C@@]2(Br)CC[C@@]1(CC(=O)O)[C@@H]2Br 103708675 OUDQDORDQBJHEI-WHGOUJPWSA-N 354.038 2.747 50 40 FFGB CSc1ncc(Cl)c(C(=O)NNC(=O)c2ccc(C)cc2C)n1 37132704 ZIRCLNIULGNTRU-UHFFFAOYSA-N 350.831 2.544 50 40 FFGB CC1=C(C)[C@H](NNC(=O)c2ccc(F)cc2)N(Cc2ccc(F)cc2)C1=O 199412969 LJBJCPNKAPXZHA-GOSISDBHSA-N 371.387 2.904 50 40 FFGB CC(=O)OCc1nc2cc(Cl)c(CBr)cc2c(=O)n1C 95079942 PYOBIHWREXAQQA-UHFFFAOYSA-N 359.607 2.545 50 40 FFGB Cc1cccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2Cl)c1 98086734 NBKUTPNYUNCAFU-UHFFFAOYSA-N 354.797 2.909 50 40 FFGB Cc1ccccc1OCC(=O)NNC(=O)c1ccc(Br)cc1 940931 IOPJCVLMSSUIGQ-UHFFFAOYSA-N 363.211 2.598 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(NC(C)=O)cc2)cc1OC 408831433 QOMMLHHRPKFGQZ-LPYMAVHISA-N 369.421 2.745 50 40 FFGB CC1(CC(=O)N/N=C/c2ccc(-c3cccc(C(=O)O)c3)o2)OCCCO1 408719760 QWCJCYMUVBEGDD-UDWIEESQSA-N 372.377 2.638 50 40 FFGB Cc1cc2c(cc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1)OCO2 408542706 NMCUKZMYLYUKKW-NSIKDUERSA-N 350.330 2.968 50 40 FFGB O=C(NNC(=O)c1cc(C2CC2)nn1-c1ccccc1)c1ccccc1O 12951195 YYGBWVVSNOXVNB-UHFFFAOYSA-N 362.389 2.530 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc1 409177472 FPPZKYLPRLUTJP-LPYMAVHISA-N 368.433 2.938 50 40 FFGB CC(=O)Nc1sc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c(C)c1C#N 107943972 YWOXTXGNWSEHEF-QGMBQPNBSA-N 371.378 2.559 50 40 FFGB C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@]3(C(=O)Nc4ccccc43)[C@@H]2C1 13510011 SLCAPPSOGCMOQX-FFUDGTDTSA-N 355.401 2.633 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2C#N)cc1 408818406 WTQYZMIYSCHCGP-XDHOZWIPSA-N 361.401 2.807 50 40 FFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/NNC(=O)Cc1ccccc1 95470876 BNHGDVNRGWUKMM-CPNJWEJPSA-N 362.433 2.773 50 40 FFGB COC(=O)c1ccc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)cc1 255842614 GMCGKEFAKWWHOL-BOPFTXTBSA-N 350.374 2.705 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)Nc3ccc(F)cc3)ccc21 3207185 LHTCLJJWADSDQZ-UHFFFAOYSA-N 355.373 2.970 50 40 FFGB N#CC1=C(SCC(N)=O)NC2=C(C(=O)CCC2)[C@@H]1c1ccccc1Cl 1087727 CMHGPHDDHSLWFX-MRXNPFEDSA-N 373.865 2.988 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)N/N=C2\C(=O)Nc3ccccc32)c1 2674767 BYPSCCRWEGUYBL-UHFFFAOYSA-N 351.406 2.970 50 40 FFGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C/c1ccc(O)cc1 3546843 ZOEYCCYESDFYOH-ZVBGSRNCSA-N 362.311 2.911 50 40 FFGB CN(C)c1ccc(/C=N\NC(=O)c2ccccc2O)cc1Br 408865818 FVMGITNDERGRSM-ZDLGFXPLSA-N 362.227 2.985 50 40 FFGB O=C(N/N=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1cccnc1 31829228 UEOQXAHFABRAIU-FBHDLOMBSA-N 363.333 2.941 50 40 FFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2cccc(O)c2)CC1 409005752 LBKOZZOOIQQVIV-HYARGMPZSA-N 365.433 2.703 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)cc1 32581096 YQJHPIGPZCMWGL-KEBDBYFISA-N 360.797 2.964 50 40 FFGB N#Cc1ccc(-c2cc(C(=O)NNc3ncnc4ccccc34)n[nH]2)cc1 1775971167 ORJWBEPXTFSAKB-UHFFFAOYSA-N 355.361 2.648 50 40 FFGB COC(=O)N/N=C(\C)c1cc(Br)cc(Br)c1O 96288996 VIAHIOSFEDWDFO-WLRTZDKTSA-N 366.009 2.997 50 40 FFGB O=C(N/N=C/c1ccccc1F)C(=O)Nc1cccc(Br)c1 59515425 DJHUOSKIAUSQGU-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB Cn1cc(C(=O)NNS(=O)(=O)c2ccc(Cl)s2)c2ccccc21 9368759 HOGUFGWWDSHDSV-UHFFFAOYSA-N 369.855 2.517 50 40 FFGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)/C=C1\Nc2ccccc2NC1=O 408974017 UPVZURUITUQUBK-DABDJHBXSA-N 359.389 2.875 50 40 FFGB C/C(=N\NC(=O)Cn1c(C)nc2ccccc21)c1cccc([N+](=O)[O-])c1 33042805 DIPOSYVAXJSBMQ-UDWIEESQSA-N 351.366 2.793 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc1OCC 47080782 DZAHJJMHMIYQNY-RGVLZGJSSA-N 356.378 2.977 50 40 FFGB CC(=O)O[C@@H]1[C@@H]2C[C@@H]([C@@H]1Br)C(C(F)(F)F)(C(F)(F)F)N2 100145281 FCKCEYSPFMHAJD-ZTYPAOSTSA-N 370.087 2.537 50 40 FFGB O=C1O[C@H]2[C@@H]3C[C@H]([C@@H](C(=O)Nc4cccc(Cl)c4)[C@@H]13)[C@H]2Br 102615314 IFAQTGVULZCIDC-HKLHZYFVSA-N 370.630 2.850 50 40 FFGB C/C(=N\NC(=O)Cc1ccccc1)[C@@H](c1ccccc1)N1CCOCC1 25686150 NOGMXHXZSMRYNZ-LXDMNWQESA-N 351.450 2.795 50 40 FFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCc3ccccc3)ccc21 3283646 DUGOTAFXRHQZPM-UHFFFAOYSA-N 350.422 2.758 50 40 FFGB CC(C)(C)OC(=O)N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O 4547457 PTELEFWOSHLPPQ-MKMNVTDBSA-N 360.164 2.922 50 40 FFGB O=C(CN1Cc2ccccc2C1)N/N=C/c1cccc(Br)c1 409194562 NAJNPBAVFHYOPD-DJKKODMXSA-N 358.239 2.915 50 40 FFGB CCc1cc(C)cc(OCC(=O)N/N=C\c2ccc(N3CCOCC3)o2)c1 409016783 VRZIUYDZISJPRL-BKUYFWCQSA-N 371.437 2.516 50 40 FFGB COc1ccccc1NC(=O)N/N=C\c1ccc(N2CCOCC2)cc1C 409072354 JUXHSWOYTWLOSS-STZFKDTASA-N 368.437 2.996 50 40 FFGB Cn1ncc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1C(F)(F)F 253408987 ZFCFLGPFONDJFB-GFCCVEGCSA-N 366.343 2.890 50 40 FFGB C/C(CC(=O)Nc1ccc(Cl)cc1Cl)=N/NC(=O)c1cnccn1 13142682 TXGGRCYOIHKRKI-NKVSQWTQSA-N 366.208 2.918 50 40 FFGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 859751 KIGIERXBTLCGIH-NTEUORMPSA-N 351.318 2.927 50 40 FFGB Cc1ccc(C(=O)NNC(=O)NC23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 4646341 DITJPGFIPQDHLJ-UHFFFAOYSA-N 372.425 2.816 50 40 FFGB O=C(Nc1ccccc1)Nc1snnc1C(=O)N/N=C/c1ccccc1 1416984 ILHJVLMIKYVXGY-WOJGMQOQSA-N 366.406 2.946 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1cc(C)n(-c2cccc(C)c2)c1C 408968928 CYHGJWREKMIRTE-FYJGNVAPSA-N 354.454 2.721 50 40 FFGB C[C@@H](Br)C(=O)NC[C@@H](O[C@@H]1CCOC1)c1cccc(F)c1 95097933 VHPHYPYBRHIIEX-LERXQTSPSA-N 360.223 2.572 50 40 FFGB O=C(CSc1nnnn1-c1ccccc1)N/N=C/c1ccc(Cl)cc1 1500927 IEDRDWGWRAOBHA-VCHYOVAHSA-N 372.841 2.558 50 40 FFGB CC1CCN(C(=O)c2cccc3c2-c2ccccc2/C3=N\NC(N)=O)CC1 6308195 XQGXNPJGHHGSMK-FCDQGJHFSA-N 362.433 2.960 50 40 FFGB N#C/C(=C\N1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccccc1 20403619 DZNHQDAEWKVHJC-DYTRJAOYSA-N 360.461 2.528 50 40 FFGB Cn1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c2ccccc21 12557778 DGVOUBAPKZKFBS-UHFFFAOYSA-N 359.332 2.855 50 40 FFGB COc1cccc([C@H]2[C@@H]3C(=C[C@H]4CC[C@H]3N4C)C(C#N)=C(N)C2(C#N)C#N)c1 108267522 FECXSRCBUAIHFT-DMSXTEQDSA-N 371.444 2.581 50 40 FFGB COc1ccc(C(=O)NNC(=O)c2nc(-c3ccccc3)oc2C)cc1 12614888 STJFGUFZHGNXEW-UHFFFAOYSA-N 351.362 2.733 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2OC)cc1 59433957 LJWONVUQIUZPAW-FYJGNVAPSA-N 367.405 2.657 50 40 FFGB O=C(CCC(=O)c1cccs1)NNC(=O)Cc1c[nH]c2ccccc12 6602974 IIMSQHSYYDFJNO-UHFFFAOYSA-N 355.419 2.582 50 40 FFGB COc1cc(N2CCCC2)c(OC)cc1/C=N/NC(=O)Cc1ccccc1 409093681 BCBFUHQRXPWZAW-PXLXIMEGSA-N 367.449 2.997 50 40 FFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=O)c2ccc(C)cc2)cc1 5873408 NIBIQCFIVSEJCI-UHFFFAOYSA-N 369.421 2.574 50 40 FFGB C/C(=C\C(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1ccncc1 409358619 MNWOIJAIYYEICV-VOTSOKGWSA-N 373.228 2.622 50 40 FFGB COc1ccc2ccc(OC)c(/C=C(/C#N)C(=O)N3CCOCC3)c2c1 409008115 UCPNDUDRNUIOBF-PTNGSMBKSA-N 352.390 2.623 50 40 FFGB C[C@H](Cl)C(=O)NCCNC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 65549742 SOVWOOFLXAHZIV-VHSXEESVSA-N 365.783 2.809 50 40 FFGB CCc1ccc(C(=O)NNC(=O)CCCOc2ccc(OC)cc2)cc1 6560736 WIAOOPMCLDJAKX-UHFFFAOYSA-N 356.422 2.878 50 40 FFGB CN(C)c1ccc(/C=N\NC(=O)COc2cccc(Br)c2)o1 409002141 YDZHJNHULRUEAK-MFOYZWKCSA-N 366.215 2.637 50 40 FFGB O=C(COc1ccc2ccccc2c1)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 36234129 JGYLAACIEVYYEL-RGVLZGJSSA-N 365.345 2.983 50 40 FFGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)c1ccccc1Br 36239670 BMXGGVKKXQYTBO-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)N/N=C2\C(=O)N(C)c3ccccc32)c1 5578486 SPOUFQOUZGKKQV-ATJXCDBQSA-N 365.433 2.994 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2cc([N+](=O)[O-])ccc2OC)ccc1OC 408569230 ZPTYPTOTCFICBN-YBFXNURJSA-N 373.365 2.775 50 40 FFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)Cc1ccccc1)C(=O)N2 18066575 AHQHUEOGIYRWSE-UHFFFAOYSA-N 372.222 2.773 50 40 FFGB CC(=O)Oc1ccc(Br)cc1/C=N/NC(=O)c1ccco1 408759367 CWTZSNGGTBPCFS-LZYBPNLTSA-N 351.156 2.731 50 40 FFGB O=C(N/N=C\c1ccc([N+](=O)[O-])s1)c1cc(Br)ccc1O 16384343 LZTHEFWNJBNGRW-NSIKDUERSA-N 370.184 2.888 50 40 FFGB CCOc1ncccc1C(=O)NNC(=O)CSc1ccc(Cl)cc1 6085163 BCAROGLFAQDWGL-UHFFFAOYSA-N 365.842 2.687 50 40 FFGB CC(C)NC(=C(C#N)C#N)[C@]1(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)C1(C#N)C#N 78547421 BEFGDEWGNRZEOL-LPHOPBHVSA-N 371.360 2.535 50 40 FFGB Cc1nc2c(c(=O)n1C)[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 20102544 MNUQMEIOUYTDQW-GFCCVEGCSA-N 363.204 2.614 50 40 FFGB Cc1cc(OCC(=O)NNC(=O)c2cccs2)ccc1Br 829227 SWVKOCLCVGNZGD-UHFFFAOYSA-N 369.240 2.659 50 40 FFGB COc1ccc(NC(C)=O)cc1N/C=C1/C(=O)OC(=O)c2ccccc21 6905508 IYWLQCQAWWQXDE-XNTDXEJSSA-N 352.346 2.804 50 40 FFGB Cc1cc(N(CCCl)CCCl)ccc1/C=N\C(C#N)=C(\N)C#N 104228751 ZHANMIIOHWTZAR-JCAXBLPDSA-N 350.253 2.915 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])c2cccnc2c1O)c1ccc(F)cc1 59459112 PESVIZGTTASUDV-AWQFTUOYSA-N 354.297 2.752 50 40 FFGB COc1cccc2cc(C(=O)N/N=C/c3cccc([N+](=O)[O-])c3O)oc12 409076213 ZRRKBDCPOUGLSO-GIJQJNRQSA-N 355.306 2.819 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(N2CCCCC2)o1 60685978 IXIAOCLLEOHIOS-DEDYPNTBSA-N 357.410 2.808 50 40 FFGB CCOc1ccccc1/C=N/NC(=O)C(=O)Nc1ccccc1OCC 5908384 OARJHWUWEOSMTJ-DEDYPNTBSA-N 355.394 2.573 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)CCC(=O)Nc2ccc(F)cc2)c1 3211954 DVUHFOQENHBFRL-CIAFOILYSA-N 373.384 2.712 50 40 FFGB COc1ccccc1NCC(=O)NN=C1CCN(Cc2ccccc2)CC1 57270426 AITQYCSRSWCZHJ-UHFFFAOYSA-N 366.465 2.875 50 40 FFGB CCOc1ccccc1OCCCC(=O)NNC(=O)c1cc(C)oc1C 3411277 SCBKLURBTSXYGA-UHFFFAOYSA-N 360.410 2.915 50 40 FFGB O=C(S[C@@H]1CS(=O)(=O)C[C@@H]1Cl)c1ccccc1Br 16789897 VYPSIHSPXGUPES-VHSXEESVSA-N 369.689 2.727 50 40 FFGB CCCc1n[nH]c2c1[C@H](c1ccc(OC)c(OCC)c1)C(C#N)=C(N)O2 5123848 PHPKNLYLCWLWRV-MRXNPFEDSA-N 354.410 2.988 50 40 FFGB O=C(Cc1ccc(Cl)cc1)NN[C@H](C(=O)NC1CC1)c1ccccc1 12763978 DDIFUHNPFLFTEK-SFHVURJKSA-N 357.841 2.523 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2OC)ccc1OCC#N 107949301 OGOMRRKIJGWFIO-CIAFOILYSA-N 353.378 2.679 50 40 FFGB O=C(NNC(=O)c1cc2ccccc2oc1=O)c1cc2c(s1)CCCC2 3449042 ZUYTVYDQJIUYAQ-UHFFFAOYSA-N 368.414 2.808 50 40 FFGB O=C(N/N=C/c1cccs1)C1CCN(C(=O)c2ccc(F)cc2)CC1 409005707 KBNQNVIIFMWSIB-UDWIEESQSA-N 359.426 2.890 50 40 FFGB CCOc1cc2c(cc1/C=N\NC(=O)c1cccc(N(C)C)c1)OCO2 409104553 JSLMMEJTSDYCDT-JAIQZWGSSA-N 355.394 2.644 50 40 FFGB CCO[C@H](C)n1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253396835 FBWOQDNOLOKQAK-BDJLRTHQSA-N 356.426 2.889 50 40 FFGB C/C(=N\NC(=O)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 12362570 ZCMVTAWXQPLZJP-XSFVSMFZSA-N 363.377 2.994 50 40 FFGB O=C(CSc1ccc(F)c(F)c1)NNc1nc(-c2ccncc2)no1 102158721 AFNVEJGWAXWEMV-UHFFFAOYSA-N 363.349 2.645 50 40 FFGB CN1C(=O)/C(=N\NC(=O)c2ccccc2)c2cc(Br)ccc21 3151300 KZVHKRWFUKTFOJ-JXAWBTAJSA-N 358.195 2.560 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)c(O)c1 6629964 SALPHAQSFDWNPR-OVBDPADQSA-N 350.422 2.996 50 40 FFGB CCCCN1C(=O)/C(=N/NC(=O)CNc2ccccc2)c2ccccc21 105501608 XFYXOMJITMQCAJ-FCDQGJHFSA-N 350.422 2.766 50 40 FFGB N#CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1 59332897 WILXVPFEJBRVPM-MNDPQUGUSA-N 372.428 2.845 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3c(OC)ccc(OC)c3[nH]2)cc1 2363395 IUGGQGOCFWZVHD-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB Cc1ccc(OCCOc2ccc([N+](=O)[O-])cc2/C=N/NC(N)=O)cc1C 4511063 UUCFAGWNOXYIHJ-RGVLZGJSSA-N 372.381 2.672 50 40 FFGB Cc1ccc(/C=N/NC(=O)CNC(=O)c2ccc(Cl)cc2Cl)o1 4086381 BIQKKTXRWNMFCW-FBCYGCLPSA-N 354.193 2.775 50 40 FFGB O=C1OC(=O)/C(=C\NC23CC4CC(CC(C4)C2)C3)C=C1Br 101193950 JRDXLWXGWRRMFC-WQLSENKSSA-N 352.228 2.791 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 6962076 QNAIKPLJSOWRMG-REIAIGDLSA-N 351.406 2.589 50 40 FFGB CC(=O)c1ccc(OCCCC(=O)NNC(=O)c2ccc(C)cc2)cc1 2629100 LLWBAGSRBAVHGR-UHFFFAOYSA-N 354.406 2.818 50 40 FFGB COc1cc2c(cc1/C=N\NC(=O)c1ccccc1-n1cccc1)OCO2 409104821 FSVMILFIXCAYPB-MTJSOVHGSA-N 363.373 2.979 50 40 FFGB C/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1ccco1 408954123 NAODSLURPBTQGL-WAYWQWQTSA-N 362.201 2.820 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1 5285199 GHNDWTHLWSUCBB-CIAFOILYSA-N 367.405 2.685 50 40 FFGB CC1(C)[C@H](C(=O)NNC(=O)c2ccccc2Cl)CC[C@@]1(C)C(=O)O 3140916 YEASDIDAPOSPIL-GTNSWQLSSA-N 352.818 2.628 50 40 FFGB CC(C)(C)c1ccc(/C=C(/C#N)C(=O)NCCCN2CCOCC2)cc1 26687151 ZXYYVPFSEOSSJD-SDXDJHTJSA-N 355.482 2.730 50 40 FFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@@H](c1cccs1)C(C#N)=C(N)O2 4247927 HEIMWOLXZMZGBF-MLGOLLRUSA-N 369.446 2.615 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c(OC)c1 408542293 KKNZAISJIHZUHM-ZSOIEALJSA-N 352.346 2.948 50 40 FFGB COc1cc(Br)c(/C=C(/C#N)C(=O)NC(C)C)cc1OC 33362203 ZIWXYHSKSTZZDC-WZUFQYTHSA-N 353.216 2.898 50 40 FFGB O=C(N/N=C/c1ccc(O)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 13921771 XFBGPFCXHBDIKP-QGMBQPNBSA-N 352.177 2.788 50 40 FFGB CN(C)c1ccc(/C=C(\C#N)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 704187 GEJLBOUSNQRBFF-INRPQCPQSA-N 363.377 2.718 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)c2n[nH]c3c2CCCC3)c(O)c1 12411686 TYLGKJYQQKEWEX-NDENLUEZSA-N 355.442 2.604 50 40 FFGB COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCOCC3)c2C)cc1 24374504 OPEKSEODGUUNRB-QGOAFFKASA-N 365.433 2.869 50 40 FFGB CCC(=O)N1CCN(c2ccccc2[C@@H]2C[C@H](C(=O)Cl)CC2=O)CC1 57328013 RZXGKWKGMYYWGI-ZFWWWQNUSA-N 362.857 2.573 50 40 FFGB CCOC(=O)/C(C#N)=C/c1c(Oc2ccccc2)nc2ccccn2c1=O 2409056 ISPQPGLXYWBQAP-WYMLVPIESA-N 361.357 2.957 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1O 3570767 SAEOUOGLQVWUSK-MDWZMJQESA-N 352.346 2.718 50 40 FFGB CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(O)cc2)N2NC=C(C#N)C2=N1 13569502 GVEVJJMKQBCOSY-IBGZPJMESA-N 371.400 2.986 50 40 FFGB O=C(N/N=C/c1c(Cl)cccc1Cl)c1ccc(-n2cnnn2)cc1 6652191 QXZACYRFEJAGJY-QGMBQPNBSA-N 361.192 2.733 50 40 FFGB O=C(Cc1ccccc1Cl)NNC(=O)c1cncn1-c1ccccc1 7137323 HWLDWZWGDZNNRE-UHFFFAOYSA-N 354.797 2.529 50 40 FFGB Cc1cccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccco3)c2)c1 66558835 PWDFUWUYQODIBC-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)c2ccc3c(c2)OCO3)cc2c1OCCO2 48333047 REESGCCYVKZFCY-NSIKDUERSA-N 365.341 2.985 50 40 FFGB COc1ccc2nc(N[C@@]3(C(F)(F)F)C(=O)NC(C)=C3C#N)sc2c1 12402641 AGXWVMHNTCWIPQ-CQSZACIVSA-N 368.340 2.945 50 40 FFGB Nc1nonc1C(=O)N/N=C/c1ccc(-c2cccc(Cl)c2Cl)o1 59419051 MZBMDMVSFZPLTK-NGYBGAFCSA-N 366.164 2.983 50 40 FFGB O=C(CCl)N(c1ccc(C(F)(F)F)cc1)[C@H]1C=CS(=O)(=O)C1 217385732 CLRLFHURXJRROJ-NSHDSACASA-N 353.749 2.588 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccco2)cc(Br)c1OC 827322 LRCHKTUBEQLDLR-LZYBPNLTSA-N 353.172 2.823 50 40 FFGB COc1ccc(CC(=O)N/N=C/C=C/c2cccc([N+](=O)[O-])c2)cc1OC 2297553 SBCWZYDVFQSFID-PHNSAVJNSA-N 369.377 2.970 50 40 FFGB C[C@@H]1C[C@@H]1c1ccc(/C=C/C(=O)NNC(=O)COc2ccccc2C#N)o1 16205094 XLCNPCJJVPQKJY-BZXHDYIJSA-N 365.389 2.514 50 40 FFGB N#C/C(=C\c1cc(Cl)ccc1OCC(N)=O)C(=O)Nc1ccc(F)cc1 409221875 BLGIUXYLOLJYNV-KPKJPENVSA-N 373.771 2.889 50 40 FFGB CC(=O)Oc1ccc(/C=N/NC(=O)c2ccco2)cc1Br 408758977 VVZUWLDLXBPBNA-LZYBPNLTSA-N 351.156 2.731 50 40 FFGB O=C(CNc1ccc(F)cc1)N/N=C/c1ccc(O)c(Br)c1 409354331 CIJSYJKTXADAKR-UFWORHAWSA-N 366.190 2.856 50 40 FFGB CC(=O)N/N=C(/S)NC=C(C(=O)c1ccccc1)C(=O)c1ccccc1 5602299 DMBVRJQETGQVOL-UHFFFAOYSA-N 367.430 2.563 50 40 FFGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@]12C(=O)Nc1ccc(F)cc12 985182 RSVVJPXKGUWJEJ-FQEVSTJZSA-N 373.347 2.540 50 40 FFGB CCc1ccc(N2C[C@H](C(=O)N/N=C/c3cccc(OC)c3)CC2=O)cc1 4703047 NYFLEOBIMJOXLV-NEIHUHTASA-N 365.433 2.761 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2)c2ccccc21 67132455 ZNLWSDYZZCJIND-HZPDHXFCSA-N 351.381 2.882 50 40 FFGB O=C(Cc1ccccc1)N/N=C\c1cc2c(cc1Br)OCO2 33342824 KQLYICPRFSWCIN-NVMNQCDNSA-N 361.195 2.871 50 40 FFGB N#C/C(C(=O)Nc1cccnc1)=C1/C(=O)Nc2ccc(Br)cc21 39556005 QVAYHZJWGZFFCT-OWBHPGMISA-N 369.178 2.712 50 40 FFGB CC1=C(C(=O)c2ccccc2)[C@]2(C(=O)N(C)c3ccccc32)C(C#N)=C(N)O1 49947129 LRXFBKHSEDTVFX-JOCHJYFZSA-N 371.396 2.782 50 40 FFGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=CCC[C@@H]2[C@@H]1c1ccc(OC)cc1 227041488 RJCZKWNAUSKZQS-MDKPJZGXSA-N 363.417 2.938 50 40 FFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C1(O)c2ccccc2-c2ccccc21 3140572 TZBIOAXLHKKLGD-LPYMAVHISA-N 373.368 2.961 50 40 FFGB COC(=O)c1c(I)cccc1CBr 34434499 DTOLJTTUAHSMQR-UHFFFAOYSA-N 354.969 2.973 50 40 FFGB O=C(CCl)Nc1cc2c(cc1NC(=O)c1cccs1)OCCO2 1116438210 HPZXQFCWTDEDBE-UHFFFAOYSA-N 352.799 2.949 50 40 FFGB O=C(N/N=C/c1ccccc1Br)[C@H]1COc2ccccc2O1 3475681 SHOXDCHLGQEJMG-QANDDYDISA-N 361.195 2.739 50 40 FFGB COc1ccc(C(=O)N/N=C(/C)c2ccc(NC(C)=O)cc2)cc1OC 6360886 JEIKBRYORDJFMN-MTJSOVHGSA-N 355.394 2.816 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC 2176199 PWPMWTKNRGVGED-XDHOZWIPSA-N 355.350 2.932 50 40 FFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1O)c1ccc(-n2cccc2)cc1 409102189 VEQAZVZBKLEWCD-UNOMPAQXSA-N 350.334 2.855 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)cc1OC 4502749 OCTNPKSBZSYLDD-UDWIEESQSA-N 356.378 2.629 50 40 FFGB COc1cc2c(cc1/C=N/NC(=O)c1cccc(-n3cccc3)c1)OCO2 409101228 WJOPNHSDNYKWTJ-CIAFOILYSA-N 363.373 2.979 50 40 FFGB COc1cc(N2CCOCC2)ccc1/C=C(/C#N)C(=O)NC1CCCCC1 409231592 KETGHNAGLUOJME-LGMDPLHJSA-N 369.465 2.888 50 40 FFGB COc1ccccc1NC(=O)N/N=C\c1ccc(OCC#N)c(OC)c1 33375921 XJJRPWPNOSOPMH-NDENLUEZSA-N 354.366 2.762 50 40 FFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2cccc(OC)c2)cc1 100522606 QTKKDEGCYZGUFH-HYARGMPZSA-N 369.421 2.516 50 40 FFGB CC1(C)Cc2cccc(OCC(=O)NNC(=O)c3ccc(Cl)cc3)c2O1 2623328 PHOUTNUZKZOJCB-UHFFFAOYSA-N 374.824 2.894 50 40 FFGB COc1ccc(C(=O)N/N=C2\NC(=O)/C(=C/c3ccc(C)cc3)S2)cc1 4903624 XOYWOVXZHAVSJK-WJDWOHSUSA-N 367.430 2.909 50 40 FFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccc(N(C)C)cc2)cc1Cl 59516258 YKXRNBODYGSBNI-RGVLZGJSSA-N 374.828 2.503 50 40 FFGB COc1ccc(C(=O)NNc2ncnc3c2cnn3-c2ccccc2)cc1 2315710 DPSXYLFDMDCQMN-UHFFFAOYSA-N 360.377 2.581 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NCC(C)C)c(C)n1-c1ccc(Cl)cc1 58903884 RSPPCLSWGPSHNL-SSDVNMTOSA-N 374.872 2.970 50 40 FFGB CCCOc1ccc(C(=O)NNC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)O)cc1 2797211 NQQSZLWXQJHCBC-DLBZAZTESA-N 374.437 2.684 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)[C@@H]1[C@@H]2CCCC[C@]21C 408722431 IVQJTYNCUVQSMB-DALDERSTSA-N 361.398 2.888 50 40 FFGB COc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)cc1[N+](=O)[O-] 408979640 NOGUVALQPKOLDB-DJKKODMXSA-N 367.365 2.632 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)NC)ccc1Oc1ccc([N+](=O)[O-])cn1 409211924 KTDYWQNXYXXUTQ-JYRVWZFOSA-N 368.349 2.834 50 40 FFGB Cn1cnc(S(=O)(=O)N2CCC[C@@H](O[Si](C)(C)C(C)(C)C)C2)c1 585138632 UGAJKAFDNCPEGD-CYBMUJFWSA-N 359.568 2.595 50 40 FFGB CCO/C=N\C1=C(C#N)SC2=N/C(=C\c3ccc(OC)cc3)C(=O)N21 16958911 QWXSUNLIDKDWMQ-QDRMOUQYSA-N 354.391 2.739 50 40 FFGB COC(=O)c1ccc(C(=O)OC)c(NC(=O)/C(C#N)=C\c2ccccc2)c1 5669692 NDPHUQXJPYRSKI-GDNBJRDFSA-N 364.357 2.805 50 40 FFGB Cc1ccc([C@@H]2CC(=O)NC(SCC(=O)N3CCCC3)=C2C#N)cc1 639251 WMTHOOJUATUUNX-HNNXBMFYSA-N 355.463 2.689 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cc1OC 107655354 CPCKFQHPGABCAG-UDWIEESQSA-N 355.394 2.816 50 40 FFGB Cc1cc(C)cc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)c1 20208459 LVBIZNHFSOHWGY-UHFFFAOYSA-N 365.499 2.896 50 40 FFGB O=C(NNC(=O)c1cc(Br)ccc1Cl)c1cccc(O)c1 8727949 LJUXHYNPWXPNIX-UHFFFAOYSA-N 369.602 2.883 50 40 FFGB NC(=O)COc1c(Cl)cc(/C=N\NC(=O)c2ccccc2)cc1Cl 409251106 OJZCFUSWNRUBFY-ZBKNUEDVSA-N 366.204 2.621 50 40 FFGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)c1ccccc1-n1cccc1 36201095 AOEQJCLFAWMUPL-XDHOZWIPSA-N 350.334 2.855 50 40 FFGB O=C(NNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 3560852 LXMJIFMXYABGBS-UHFFFAOYSA-N 354.149 2.976 50 40 FFGB CC(C)C(=O)N/N=C\c1ccc(OCC(=O)NCCc2ccccc2)cc1 58883331 MRBGSOXFZCFJOF-UCQKPKSFSA-N 367.449 2.530 50 40 FFGB COc1cc(/C=N\NC(=O)c2cc3ccccc3o2)ccc1OCC(=O)O 408820086 VAOMGAGEBCCHJF-JMIUGGIZSA-N 368.345 2.669 50 40 FFGB C=CCc1cc(/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1O 409208355 AWFULXTXLIKDCP-ODLFYWEKSA-N 355.350 2.801 50 40 FFGB CCN(Cc1ccc2c(c1)OCO2)C(=O)NNC(=O)c1ccc(C)cc1 32794921 WXJZICMZUNOYOT-UHFFFAOYSA-N 355.394 2.600 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC 408832443 TYISEIHYLRKYGQ-VCHYOVAHSA-N 373.321 2.513 50 40 FFGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCCOc1cccc(C)c1 13943120 VMNFGRQSJYOLED-LFIBNONCSA-N 352.390 2.854 50 40 FFGB Cc1c(C(=O)NNS(=O)(=O)c2ccc(F)cc2F)oc2ccccc12 7380312 OBHQNBWXQVONKB-UHFFFAOYSA-N 366.345 2.643 50 40 FFGB CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)COc1ccccc1 409002375 UDLBIPKTYVNPNR-DEDYPNTBSA-N 370.409 2.970 50 40 FFGB COc1ccc(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 33907686 MZUIIYVTSBQIIK-IXGURIBZSA-N 351.406 2.507 50 40 FFGB COc1ccc(OCC(=O)N/N=C\c2cc(OC)c(OC)cc2C)cc1 33714882 UBKXEJLVYPMNEE-JAIQZWGSSA-N 358.394 2.550 50 40 FFGB CNC(=O)/C(C#N)=C/c1c(Oc2ccccc2C)nc2c(C)cccn2c1=O 2408446 OJIVVCZZDHYIHG-RVDMUPIBSA-N 374.400 2.757 50 40 FFGB C[C@]12CC[C@H]3[C@@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@@H]1C[C@@H](O)[C@]2(O)C#N 118918506 VZFYGLAXUCFBQI-MULRRPPESA-N 373.493 2.918 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)N(C)C)c(Br)cc1OC 59334711 PAQGNMKIKVOYJY-WDZFZDKYSA-N 353.216 2.852 50 40 FFGB CC(C)(C)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 3371764 VIWGUHKVTPSQNV-UHFFFAOYSA-N 354.406 2.602 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)C23CCC4C[C@@H](C[C@H](C4)C2)C3)cc1 102946332 VDZJRRIVPUYNRH-IOSXPMGOSA-N 362.495 2.911 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(COC(C)C)cc2)c1 7540812 FTSGGZZYJGFUNO-UHFFFAOYSA-N 372.421 2.704 50 40 FFGB Cc1ccc(C(=O)NNC(=O)N2CCN(c3cccc(C)c3C)CC2)cc1 17447040 RVTYGLVGLPIIFK-UHFFFAOYSA-N 366.465 2.788 50 40 FFGB Cc1ccc(Cc2c(N)nn3c2N[C@H](c2cccnc2)C(C#N)=C3N)cc1 8707054 JZQVAUJLXYAWLN-QGZVFWFLSA-N 357.421 2.577 50 40 FFGB C#CCOc1ccc(OC)cc1/C=N/NC(=O)CNc1ccc(Cl)cc1 409364117 NBXJNWRZVJHTBU-WSDLNYQXSA-N 371.824 2.923 50 40 FFGB O=C(O)Cc1cc(Nc2ncnc3cc(OCCCCl)ccc23)n[nH]1 44137914 HEDQWHFFFGTORJ-UHFFFAOYSA-N 361.789 2.731 50 40 FFGB O=C(N/N=C/c1cccc(C(F)(F)F)c1)[C@H]1COc2ccccc2O1 3475560 QRAICSDSMJABTH-MNPVBQOISA-N 350.296 2.996 50 40 FFGB N#C/C(=C/c1ccncc1)c1nnc(N2CCOCC2)n1-c1ccccc1 33825413 QEOCLQJILUZSRC-VKAVYKQESA-N 358.405 2.563 50 40 FFGB O=C(NNC(=O)c1cccnc1O)c1ccc(-c2ccc(F)cc2)s1 10735856 OQNYXWQWVPJZNG-UHFFFAOYSA-N 357.366 2.730 50 40 FFGB O=C(NCCc1ccc(F)cc1)NNC(=O)c1cc2ccccc2cc1O 12917274 YSWWQBXDYWZTNM-UHFFFAOYSA-N 367.380 2.871 50 40 FFGB CN(C)c1ccc(C(=O)NNC(=O)c2cc3cc(Cl)ccc3n2C)cc1 4675535 LWYVWIXJGQWLEJ-UHFFFAOYSA-N 370.840 2.973 50 40 FFGB Cc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)c(Cl)c1 32118779 JXNPGLKLIWCOOA-UHFFFAOYSA-N 353.856 2.659 50 40 FFGB COc1ccc(-n2cc(C(=O)NNc3cccc(C)c3Cl)nn2)cc1 1158114861 RXTNIYCTAWTZIF-UHFFFAOYSA-N 357.801 2.995 50 40 FFGB Nc1nonc1C(=O)N/N=C/c1ccc(-c2ccc(Cl)cc2Cl)o1 974471 ZTXVAMNUOZUNOX-NGYBGAFCSA-N 366.164 2.983 50 40 FFGB Cc1cc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c2c(C)noc2n1 22138977 UJQPIXTVJNCSQG-UHFFFAOYSA-N 368.437 2.817 50 40 FFGB CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(C(=O)OC)cc2)C1=O 8993613 SMTWPWHGGOIHER-ZSAINHDTSA-N 367.405 2.776 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)CNC(=O)c2cccc(F)c2)cc1 3081055 RHZRDDIMQPUNGJ-YDZHTSKRSA-N 370.428 2.552 50 40 FFGB COc1ccccc1Nc1nnc(SCC(=O)/C(C#N)=C(/C)N)s1 104709388 JJYCZZWRNPICAK-KTKRTIGZSA-N 361.452 2.708 50 40 FFGB CCCNC(=O)CSC1=C(C#N)[C@H](c2ccc(Cl)cc2)CC(=O)N1 6324056 UHMUBIDFIRWRAB-ZDUSSCGKSA-N 363.870 2.938 50 40 FFGB O=C(COC(=O)c1ccccc1Cl)NNC(=O)c1ccccc1Cl 8433656 ATPNPNIXAXIDHU-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCc3ccccc32)c1 24748566 WHMOUQODVUUIHG-GOSISDBHSA-N 354.406 2.585 50 40 FFGB Cc1ccc(C(=O)/C=C(/O)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 100134898 QMXTXZYGKPQKNV-JKQIVKDKSA-N 353.334 2.678 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc([N+](=O)[O-])c1O 36185571 HAQXSQVDXUPVLF-IZZDOVSWSA-N 355.306 2.560 50 40 FFGB CCCc1noc(CCC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)n1 28409289 QJLWMCAMNFHJHG-UHFFFAOYSA-N 358.442 2.713 50 40 FFGB Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c(C)c1 12985580 BGAHASFHTPALJZ-UHFFFAOYSA-N 364.492 2.785 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)CSc2nnc(C)s2)cc1 5736411 SJXBXWVGJZGOJN-LICLKQGHSA-N 363.512 2.935 50 40 FFGB Cc1ccc(CSCC(=O)NNC(=O)COc2cccc(C)c2)cc1 24582333 CJNFVYGEUWXALV-UHFFFAOYSA-N 358.463 2.763 50 40 FFGB O=C(N/N=C/c1ccc(I)o1)c1ccc(F)cc1 36174341 MCABDMNGBFMREI-VIZOYTHASA-N 358.110 2.787 50 40 FFGB CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCc2ccccc21 13011663 DJYGOOCQMDVGGR-KRWDZBQOSA-N 368.433 2.732 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1ccc(-n2cccc2)cc1 6644112 PZAAVMIZHXYSQA-UHFFFAOYSA-N 350.447 2.786 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2ccccc2C)cc1OC 9201943 MHGSNFMFPZSGTK-CIAFOILYSA-N 370.405 2.709 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)Cc1cccc2ccccc12 4680466 XMZAOWJRAPTDRK-UHFFFAOYSA-N 364.401 2.617 50 40 FFGB O=C(CCCc1ccc2c(c1)-c1ccccc1C2)NNC(=O)[C@H]1CCCO1 84576861 CFPQJWNVRFRICO-HXUWFJFHSA-N 364.445 2.907 50 40 FFGB O=C(CCc1ccco1)NNC(=O)c1ccc(COc2ccccc2)o1 22190748 MYSJNOONLSRURH-UHFFFAOYSA-N 354.362 2.845 50 40 FFGB O=C(N/N=C1\C(=O)N(CN2CCCCC2)c2ccccc21)c1cccs1 100685891 KWZCXTWTMWDGMX-JZJYNLBNSA-N 368.462 2.672 50 40 FFGB COc1ccc(/C=N/NC(=O)c2c[nH]c3ccccc23)c(OC)c1OC 2779761 XBNSACDLNOYJHI-UFFVCSGVSA-N 353.378 2.958 50 40 FFGB O=C(CC(=O)NC1CCCCC1)N/N=C/c1ccccc1C(F)(F)F 4525696 QKCXOTMRXQPEBW-SRZZPIQSSA-N 355.360 2.995 50 40 FFGB C[C@@H]1CN(C(=O)NNC(=O)c2ccc(F)cc2)C[C@H](c2ccccc2)O1 67874499 AUCXPYSMWZKHPX-CXAGYDPISA-N 357.385 2.642 50 40 FFGB CCOc1ccc([C@@H]2C(C(=O)OC)=C(C)N=C3SC(C#N)=C(N)N32)cc1 408608481 WOTVPOBSTRFQPO-OAHLLOKOSA-N 370.434 2.643 50 40 FFGB CN1CCC(=NNC(=O)CC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 408973727 QFIKXFVJOQHRGC-UHFFFAOYSA-N 357.241 2.520 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)c(C(=O)O)c2)cc1 408724705 GWRPVLHRLAQWCN-LCYFTJDESA-N 352.346 2.948 50 40 FFGB O=C(CCC(=O)N/N=C/[C@@H]1C[C@@H]2CC[C@@H]1C2)N/N=C/[C@H]1C[C@H]2CC[C@@H]1C2 225690988 NXDNIKYHOJFYMV-BEBGVKFNSA-N 358.486 2.843 50 40 FFGB O=C(Cc1ccccc1)N/N=C/CCC/C=N/NC(=O)Cc1ccccc1 4405285 AAEZCJAIXULGBS-HOFJZWJUSA-N 364.449 2.846 50 40 FFGB CCCc1ccc(N2C[C@H](C(=O)NNc3nc(C)cc(C)n3)CC2=O)cc1 12553715 ZHKGMMDSBUPWIY-MRXNPFEDSA-N 367.453 2.542 50 40 FFGB O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(-c2ccccc2)cc1 3339622 FCEMEWRBURSODL-FQEVSTJZSA-N 374.396 2.955 50 40 FFGB COc1cccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c1 4721459 FAMREHJCNZQNEU-INIZCTEOSA-N 358.353 2.836 50 40 FFGB O=C(CNc1nc(-c2ccccc2)no1)N/N=C/c1ccc(Cl)cc1 5604592 YXRLPTWXZOGRGT-KEBDBYFISA-N 355.785 2.952 50 40 FFGB CC(=O)O[C@H]1C[C@@H]2[C@H](Br)[C@@H]1NC2(C(F)(F)F)C(F)(F)F 100040616 RMADYUJTAOPBEY-JRTVQGFMSA-N 370.087 2.537 50 40 FFGB CC[C@H](C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccccc1 1744030 LHZNWNGPOBMHCK-HNNXBMFYSA-N 372.421 2.667 50 40 FFGB CC/C(=N\NC(=O)c1ccco1)c1ccc(OCCN2CCOCC2)cc1 20551596 HTUKFERFICVRHI-DYTRJAOYSA-N 371.437 2.535 50 40 FFGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccccc1C(=O)O 408924200 LYPLPPNOWHQDKS-XYOKQWHBSA-N 367.317 2.847 50 40 FFGB Cc1cc([N+](=O)[O-])nn1CC(=O)N/N=C\c1c(Cl)cccc1Cl 4647134 KKTWVYNOCJUUPH-SOFYXZRVSA-N 356.169 2.557 50 40 FFGB O=C(CNc1nc2ccccc2s1)NNC(=O)c1cc2ccccc2o1 14136752 URAWRHASTRBLME-UHFFFAOYSA-N 366.402 2.916 50 40 FFGB Cc1nc(N2CCOCC2)sc1C(=O)N/N=C/C1=CC[C@H]2C[C@H]1C2(C)C 103390662 KTUZENLGHVNKPG-ZHLFYBBGSA-N 374.510 2.996 50 40 FFGB CCCCNC(=O)CSC1=C(C#N)[C@H](c2ccc(C)cc2)CC(=O)N1 6323072 RVMQLISEPZHRRO-HNNXBMFYSA-N 357.479 2.983 50 40 FFGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCCOc1ccc(C)cc1 4603045 BIORMBOGRVBPAQ-LFIBNONCSA-N 352.390 2.854 50 40 FFGB N#CCC(=O)N/N=C/c1cn(CC(=O)Nc2ccccc2)c2ccccc12 4739621 GVWOGJMJEJVISG-WSDLNYQXSA-N 359.389 2.644 50 40 FFGB CC[C@H]1CCc2sc(C(=O)NNC(=S)NC[C@H]3CCCO3)cc2C1 7974455 VLXIWWWCXHZMOL-WCQYABFASA-N 367.540 2.551 50 40 FFGB O=C(CCl)N(c1cc(Cl)ccc1Cl)[C@H]1CCS(=O)(=O)C1 111923892 CYFZGQALKHKOSF-VIFPVBQESA-N 356.658 2.752 50 40 FFGB COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1 660029 NQHXAMLSFWABPY-MRXNPFEDSA-N 373.368 2.533 50 40 FFGB CC1=NN(c2ccccc2)C(=O)/C1=C(\NNC(=O)C(C)C)C(F)(F)F 100509960 LUMRBWFIGSJJSP-SEYXRHQNSA-N 354.332 2.502 50 40 FFGB C#CCOc1c(Br)cc(/C=C(\C#N)C(=O)NCC)cc1OC 408814991 QWXRUCCPMCYCPF-KPKJPENVSA-N 363.211 2.513 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)COc2ccccc2)cc1[N+](=O)[O-] 408530003 KSKDCWVTUBOAPJ-CPNJWEJPSA-N 357.366 2.913 50 40 FFGB CC(=O)/C(C#N)=C1\NC(=O)[C@@H](Cc2ccc(Br)cc2)S1 100983035 GZAPPVNNNJMCJQ-SLQMCABGSA-N 351.225 2.547 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(Br)o2)cc(OC)c1O 687049 SJEJLHQLTMIKGP-FRKPEAEDSA-N 369.171 2.529 50 40 FFGB O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc(Br)o1 12567833 QWAJTIFDOWGARR-UHFFFAOYSA-N 362.183 2.527 50 40 FFGB COC(=O)[C@@]12CC[C@@](CBr)(C(=O)[C@H]1Br)C2(C)C 8236832 PVYFESIMHVMBHV-NZXMKCKXSA-N 368.065 2.693 50 40 FFGB O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1ccc([N+](=O)[O-])cc1 1307236 WZZRFWGMOISPJH-RQZCQDPDSA-N 355.379 2.714 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2ccccc2Br)cc1 3572278 BISZDEZAYUZHFF-VCHYOVAHSA-N 361.195 3.000 50 40 FFGB Cc1cccc(C)c1NCC(=O)N/N=C1\C(=O)N(C(C)C)c2ccccc21 4077468 XJTXRJCXZFMFMI-GFMRDNFCSA-N 364.449 2.991 50 40 FFGB COc1cccc(/C=C(/C#N)C(N)=O)c1OCc1ccc([N+](=O)[O-])cc1 409078153 HDDWBKBZDYEEPQ-ZROIWOOFSA-N 353.334 2.575 50 40 FFGB COc1cc(C)c(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1OC 408549799 ZFRXCNMBNPXEQP-DJKKODMXSA-N 374.466 2.661 50 40 FFGB COc1ccc(CCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1 2627969 OJBOSWGYLHSSLR-UHFFFAOYSA-N 362.813 2.751 50 40 FFGB O=C(NNC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)c1ccco1 102366316 IBQFCQUCDSRRMW-CHISNJGVSA-N 367.243 2.775 50 40 FFGB CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 1298204 FZEYGDSMNHIVPK-ZDUSSCGKSA-N 371.393 2.948 50 40 FFGB Cc1[nH]nc(O)c1CC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 1477392 CIIODYRWCGREEM-CIAFOILYSA-N 364.405 2.696 50 40 FFGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)NNC(=O)c1cccs1 3287838 XRUIUJZBAKLZDE-UHFFFAOYSA-N 368.340 2.578 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2OC)c1 59433812 VMVVKQXELXWQCV-FYJGNVAPSA-N 367.405 2.657 50 40 FFGB COc1cc(/C=N/NC(N)=O)cc(Cl)c1OCCOc1ccccc1 4207663 ATCVIDWJCAGHPU-RGVLZGJSSA-N 363.801 2.809 50 40 FFGB CC(C)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1 7379694 LHOLRDMULDFSTQ-UHFFFAOYSA-N 364.492 2.984 50 40 FFGB O=C(N/N=C/c1cccc(Cl)c1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 409257637 RLQHLLOOCZNOLN-WVISFHDSSA-N 359.788 2.982 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(N2CCCCC2)o1 35131251 CXOAUXLMVABHLA-UYRXBGFRSA-N 356.382 2.871 50 40 FFGB N#CS[C@@]1(CN2CCOCC2)COc2c(Cl)cc(Cl)cc2C1=O 19682202 QDDHLPXBXFPQJR-HNNXBMFYSA-N 373.261 2.854 50 40 FFGB O=C(N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21)c1ccncc1 100882995 HWVSLJFEKQWPEP-NMWGTECJSA-N 356.385 2.763 50 40 FFGB Cn1cc(/C=N/NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cn1 20816589 DHOUTXFZJPXBRO-SSDVNMTOSA-N 356.389 2.794 50 40 FFGB CCCCNC(=O)CSC1=C(C#N)[C@@H](c2ccc(F)cc2)CC(=O)N1 6323105 MARUGSMBJOYLAU-CQSZACIVSA-N 361.442 2.814 50 40 FFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(OC)cc3)[C@@H]2C1 4354434 LGLXIUAZOGIRQM-UXHICEINSA-N 373.460 2.831 50 40 FFGB O=C(N/N=C/c1ccccc1OCc1ccccc1Cl)C(=O)NC1CC1 4600102 SZXSVUXCTMBWDK-SRZZPIQSSA-N 371.824 2.648 50 40 FFGB Cc1oc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1Br 408857713 LYEUHCVFDGZDLS-BYNSURFDSA-N 365.183 2.641 50 40 FFGB CN(C)c1oc(/C=C(/C#N)C(=O)NCc2ccco2)cc1Br 408860029 QVZJCQHJWGJSNW-POHAHGRESA-N 364.199 2.924 50 40 FFGB O=C(N/N=C/c1ccccc1O)C(=O)Nc1cc(Cl)cc(Cl)c1 8379990 GTQLZUUSPFRXOR-QGMBQPNBSA-N 352.177 2.788 50 40 FFGB O=C(Cc1ccccc1)N/N=C/c1cc([N+](=O)[O-])c2cccnc2c1O 59459117 BZDVMISNUCKNPP-RGVLZGJSSA-N 350.334 2.541 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)cc1OC 408860903 HWEGWPUJSDZKFJ-FYJGNVAPSA-N 370.405 2.558 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1ccccc1OCc1ccc2c(c1)OCO2 408843567 GBIFDTNSXJSGCQ-YBEGLDIGSA-N 350.374 2.989 50 40 FFGB O=C(CCl)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 70638169 QIDVMSXBBYYQFY-UHFFFAOYSA-N 351.712 2.501 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1ccc(NC(=O)c2ccco2)cc1 16595581 JXAKUGORGABABH-UHFFFAOYSA-N 363.373 2.536 50 40 FFGB COc1ccc2c(c1)c(C(=O)N/N=C\c1ccc(O)c(O)c1)c(C)n2C 58983624 GRSYYSJWKKXZNH-JMIUGGIZSA-N 353.378 2.670 50 40 FFGB CNC(=O)/C(C#N)=C\c1ccc(OCc2cccc(C(=O)O)c2)c(OC)c1 59249188 OUJWHFISMULNAI-PXNMLYILSA-N 366.373 2.625 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)ccc1O 1462464 UFLYIMNMXZJHFP-GHRIWEEISA-N 363.417 2.657 50 40 FFGB O=C(NNC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccccn1 12543364 RBDHTIOJGNLCKO-UHFFFAOYSA-N 369.384 2.767 50 40 FFGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 59515522 IZIZVTMVWGSUJT-YBFXNURJSA-N 354.366 2.807 50 40 FFGB Cc1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1Br 97164634 HKAODFRTVDPAHA-UHFFFAOYSA-N 371.626 2.932 50 40 FFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(C)oc(=O)c32)ccc1OC(C)C 4476382 RQOLJJWJRQDNLR-QGZVFWFLSA-N 368.389 2.962 50 40 FFGB N#C/C(=C\c1ccc(I)cc1)C(=O)N1CCCC1 409368974 VQURRRHLJIQQMR-FMIVXFBMSA-N 352.175 2.821 50 40 FFGB O=C(Cc1cccc(F)c1)NNC(=O)c1ccc(Br)cc1 14139387 BLGOASQSCKOAQI-UHFFFAOYSA-N 351.175 2.592 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccco3)c2)cc1 6478784 IHNGTVWNJYSNKG-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB O=C(NNC(=O)[C@@H]1CCOC1)c1ccc(COc2ccc(Cl)cc2)cc1 58412921 ONIPERYHIFQPAN-OAHLLOKOSA-N 374.824 2.717 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@H](NC(=O)Cc1cccs1)C(C)C 2057438 ZSCWRUPPVWQKHT-BAOGCXAUSA-N 373.478 2.590 50 40 FFGB O=C(Cc1cccc(C(F)(F)F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1 6224825 DEBVLQGOVMDQPL-UHFFFAOYSA-N 367.283 2.617 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])o1)CO2 1743507 ZEHOUGILTBBWID-OMPOGXFXSA-N 373.365 2.775 50 40 FFGB Cc1ccc(/C=N/NC(=O)c2c(O)c3cccc4c3n(c2=O)CCC4)cc1 100326420 GGXAXJBCBTVUKQ-WSDLNYQXSA-N 361.401 2.726 50 40 FFGB CC(C)(Cc1ccc(O)cc1)NC(=O)CC(=O)N/N=C/c1cccc(F)c1 4996306 QZKLOWNJJPYWHL-LPYMAVHISA-N 371.412 2.509 50 40 FFGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccc(N(C)C)cc1 8733445 XRSPVDURFZAEQB-CQSZACIVSA-N 370.291 2.761 50 40 FFGB O=C(CCC(=O)N/N=C/[C@@H]1C[C@H]2CC[C@H]1C2)N/N=C/[C@@H]1C[C@H]2CC[C@H]1C2 107907895 NXDNIKYHOJFYMV-DVNOBVLWSA-N 358.486 2.843 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1 3895061 XNNKZBBTWYFYHO-UHFFFAOYSA-N 358.438 2.681 50 40 FFGB O=C(O)[C@H](Br)[C@@H](Br)c1cccc([N+](=O)[O-])c1 6220961 AYUJMWVMPDGXFF-JGVFFNPUSA-N 352.966 2.879 50 40 FFGB Cc1cc(C)nc(NNC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)n1 14513846 QHPQNKMWNVXPSR-UHFFFAOYSA-N 371.441 2.875 50 40 FFGB O=C(NC/C(=N/NC(=O)c1cccnc1)c1ccccc1)c1ccccc1 18191590 SATPBHLPHGRCPK-CLCOLTQESA-N 358.401 2.646 50 40 FFGB Cc1ccccc1NC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br 408691286 ZFNUKQJPJNMCBQ-ZZWKFIDSSA-N 350.212 2.505 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc(OC)c1OC 3615849 NRUBEJFFXFTVQA-GZTJUZNOSA-N 366.417 2.978 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)ccc1O[C@@H](C)C(=O)O 23382902 PDPYGSNCQMAQDU-LERPTODRSA-N 372.421 2.903 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C/c1ccc(OC)c([N+](=O)[O-])c1 982359 HOZRGQXLLNBWFI-YBFXNURJSA-N 373.365 2.531 50 40 FFGB CCc1ccc(C(=O)NNC(=O)CNc2nc3ccccc3s2)cc1 12736312 MZUOGMWHVMLBDN-UHFFFAOYSA-N 354.435 2.732 50 40 FFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(N2CCOCC2)cc1 409108251 STTFMWJOGKYKFH-KGENOOAVSA-N 353.422 2.604 50 40 FFGB C#CCOc1c(Br)cc(/C=N/NC(C)=O)cc1Br 409010531 FILYYYBXVRVXSE-VIZOYTHASA-N 374.032 2.694 50 40 FFGB CC(=O)[C@@H]1N(S(=O)(=O)c2ccc(C)cc2)C([C@@H](C)Cl)=NC1(C)C 24718455 VLPKNRYRNYLHDY-RISCZKNCSA-N 356.875 2.761 50 40 FFGB biogenic COc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1Br 818664 UEFJCLVXKIUFFN-ZDUSSCGKSA-N 361.199 2.707 50 40 FFGB Cc1ccsc1/C=N/NC(=O)C(=O)Nc1cccc(Br)c1 59435550 LDKDLXSXFZRNSG-LZYBPNLTSA-N 366.240 2.908 50 40 FFGB CCc1c(C(=O)NNC(=O)c2ccccn2)cnn1-c1cccc(Cl)c1 24480235 FXGMBIFZIOJNIR-UHFFFAOYSA-N 369.812 2.558 50 40 FFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1c(C)nn(-c2ccccc2)c1C 2758354 UBLGKJQLYZSSPW-GOSISDBHSA-N 364.405 2.744 50 40 FFGB O=C(N/N=C/c1ccc(I)o1)c1ccccc1F 1092623 MNRSXRGBFFBLQB-VIZOYTHASA-N 358.110 2.787 50 40 FFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccc(SC)cc2)c(OC)c1 13923309 ZQHPJKJENFNYMF-YBFXNURJSA-N 373.434 2.515 50 40 FFGB CCCC(=O)Nc1ccc(C(=O)N/N=C/c2cccc(OC)c2O)cc1 1054450 OVOGGAPIXPRKAP-UDWIEESQSA-N 355.394 2.903 50 40 FFGB N#CCC(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 28214259 CITDUZUUSUSHKV-SRZZPIQSSA-N 370.796 2.721 50 40 FFGB COc1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc(OC)c1OC 59447259 UNWHKLNJGYPZHU-VXLYETTFSA-N 373.365 2.693 50 40 FFGB Cc1cc(C)n(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)c3ccccc23)n1 409380359 LOADMQIIILAMBY-XNTDXEJSSA-N 361.405 2.577 50 40 FFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\Nc1ccc(Br)c(C)c1C 16249307 QCPWUSYRBAPDPD-GHXNOFRVSA-N 360.211 2.858 50 40 FFGB CCOc1cc2c(cc1/C=N/NC(=O)Nc1ccccc1OC)OCO2 409111773 CBBVSPSXJNFFBY-VXLYETTFSA-N 357.366 2.978 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 15225718 UXEHGVKLQYVADU-PCXKXAPESA-N 353.422 2.630 50 40 FFGB O=C(N/N=C/c1ccccc1I)c1ccccc1O 3269542 MAZDSZSSNODIAR-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)c1 8339647 PXCDCJNKQIMLPS-UDWIEESQSA-N 356.378 2.629 50 40 FFGB O=C(COc1cccc2ccccc12)NNC(=S)NCc1ccccc1 4976594 YMFCLPAGCUYYIA-UHFFFAOYSA-N 365.458 2.914 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 6962066 HCZXEEBCSMQGMJ-OOXYOOLHSA-N 369.396 2.728 50 40 FFGB CCOc1ccc2nc(N/C=C3\C(=O)N(C)C(=O)C(C#N)=C3C)sc2c1 100232996 FLSLHMXANYTUQO-LCYFTJDESA-N 368.418 2.829 50 40 FFGB O=C(CCC(=O)c1cccs1)NNC(=O)c1ccccc1-n1cccc1 6509033 OQYCNJSSZUJGFE-UHFFFAOYSA-N 367.430 2.963 50 40 FFGB Cc1nc2cc(C(=O)NNC(=O)c3cccnc3)ccc2n1-c1ccccc1 15632883 VHMORKWAKILAJI-UHFFFAOYSA-N 371.400 2.804 50 40 FFGB Cc1cccc(/C=N/NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)c1 408769637 XXIKCRMVMGZLQY-UDWIEESQSA-N 373.478 2.528 50 40 FFGB CC(C)(C)c1ccc(/C=N\NC(=O)CC(=O)NCc2cccnc2)cc1 83262276 BRYTVJQSSSAYFD-UCQKPKSFSA-N 352.438 2.536 50 40 FFGB N#C/C(C(=O)COc1ccc(Cl)cc1)=C1\NC(=O)c2ccccc2N1 101151954 RQJABOOSINZNDH-SAPNQHFASA-N 353.765 2.879 50 40 FFGB Cc1ccc(C(=O)N[C@@]2(C(Cl)Cl)C(=O)N=C3SC=CN32)cc1 101411135 QBQMGWUJNUCXIT-CQSZACIVSA-N 356.234 2.641 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)[C@H](C)Oc1ccccc1F 6208717 LBRSSRJYBNKFRH-JTQLQIEISA-N 366.776 2.716 50 40 FFGB CC(=O)OCC(CBr)(CBr)CBr 1722343 HNKJDSDREJCMHR-UHFFFAOYSA-N 366.875 2.721 50 40 FFGB Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)[C@@H]2CCCO2)c(C)n1C[C@@H]1CCCO1 27896661 QHNLAJWXCNLXGR-LCQBDMFXSA-N 371.481 2.875 50 40 FFGB C[C@@H](C(=O)NN=Cc1c[nH]c2ccccc12)n1cnc2ccccc2c1=O 11847605 IMVYDLSZFTZSSH-ZDUSSCGKSA-N 359.389 2.589 50 40 FFGB COc1cc(N2CCCC2)c(OC)cc1/C=N\NC(=O)c1ccccc1O 409094847 GLCWIJMNPVGPJW-BKUYFWCQSA-N 369.421 2.774 50 40 FFGB Cc1c(/C=N/NC(=O)c2cc([N+](=O)[O-])ccc2O)c2ccccc2n1C 98087258 ASXYQPAFNMJTHI-VXLYETTFSA-N 352.350 2.864 50 40 FFGB COc1ccccc1OCC(=O)N/N=C\c1ccc(Br)o1 206596490 CNKHRGIKMNRKIZ-PXNMLYILSA-N 353.172 2.580 50 40 FFGB O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)[C@@H]1COc2ccccc2O1 2252608 IRXLKBDYWFIHOB-RJZHOQSWSA-N 367.188 2.989 50 40 FFGB N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OCCO2 13137326 YCDMGBKDFLLUIK-UKTHLTGXSA-N 351.318 2.912 50 40 FFGB CC(=O)Nc1ccccc1OC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2 6456863 IEXFUWRPKUICAJ-ZSOIEALJSA-N 350.330 2.886 50 40 FFGB CCOC(=O)COc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1 408868801 OWIHAVZHEQKWQO-KGENOOAVSA-N 354.406 2.711 50 40 FFGB O=C(CCl)N(c1c(Cl)cccc1Cl)[C@@H]1CCS(=O)(=O)C1 217380087 LLRKKPDSSXZRLS-MRVPVSSYSA-N 356.658 2.752 50 40 FFGB CC(C)CNC(=O)CC(=O)N/N=C/c1ccccc1OCc1ccccc1 3168383 JPFCDIRLYKFGFZ-OEAKJJBVSA-N 367.449 2.878 50 40 FFGB N#CC1=C(SCC(=O)N2CCCCC2)NC(=O)C[C@@H]1c1ccc(F)cc1 6495439 YLHJFACUQAHXRB-OAHLLOKOSA-N 373.453 2.910 50 40 FFGB COc1ccccc1OCC(=O)NNC(=O)CCSc1ccc(C)cc1 12820385 GEXQIAKZVKTTAQ-UHFFFAOYSA-N 374.462 2.712 50 40 FFGB CC(=O)O[C@]12[C@H](Br)[C@@H]3[C@@H]4[C@@H]5C[C@H]3[C@@H]1[C@@H]5[C@H](Br)[C@H]42 245232065 OWYYCXRWCMJAHL-FZZBBPGNSA-N 362.061 2.587 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2cc(-c3ccc(F)cc3)n[nH]2)cc1 867702 ZRMMOZNJKFHUFG-SRZZPIQSSA-N 366.352 2.766 50 40 FFGB CN(C)c1ncccc1C(=O)OCC(=O)N/N=C1/C[C@H]2CC[C@@]1(C)C2(C)C 102162922 SQUMWFRGKIOVMX-JOUFEUHRSA-N 372.469 2.623 50 40 FFGB O=C(COc1ccccc1Cl)NNC(=O)c1cc(Cl)ccc1O 722643 SUVXTZSTULLGPK-UHFFFAOYSA-N 355.177 2.539 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)cc1 2313524 UAZOUZALSBSMFN-KEBDBYFISA-N 350.378 2.502 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3sccc3C)CC2=O)cc1 409268572 VZMBQSUXLBRHEK-XTBHVRTMSA-N 357.435 2.568 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)NC2CCCCC2)cc1OCC 408718530 VRTMLPKSSWMXNZ-KGENOOAVSA-N 373.453 2.549 50 40 FFGB COC(=O)c1ccc(CBr)c(I)c1 90513336 WIEKIKAFLIHTCN-UHFFFAOYSA-N 354.969 2.973 50 40 FFGB CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](n2cc(F)c(N)nc2=O)CS1 198120234 PZAVJQRKDBGTSP-WDEREUQCSA-N 361.515 2.575 50 40 FFGB in-vitro CO[Si](OC)(OC)OCC(F)(F)C(F)(F)C(F)(F)C(F)F 169806564 NRPFONWOWYTAFW-UHFFFAOYSA-N 352.250 2.549 50 40 FFGB COc1cccc(NC(=O)/C(C#N)=C\c2ccccc2OCC(=O)O)c1 208022773 AIXOBDATQQCMEG-ZROIWOOFSA-N 352.346 2.704 50 40 FFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2)ccc1O 3166548 BLFLHTDGUMLULY-VXLYETTFSA-N 361.785 2.533 50 40 FFGB O=C(CN1CCCCC1)NC(=O)N(/N=C\c1ccco1)c1ccccc1 8618848 DABPQKWJWSXAGM-ZHZULCJRSA-N 354.410 2.842 50 40 FFGB COc1ccccc1/C=C\C(=O)NCC(=O)N/N=C(\C)Cc1ccccc1 4807977 COWKXEFLKKKGKZ-KAHMWRCASA-N 365.433 2.559 50 40 FFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)NCc1cccs1 15933945 LUPQJUZKCUAPDN-NTUHNPAUSA-N 358.419 2.997 50 40 FFGB COc1ccc(/C=N\NC(=O)c2cccnc2)cc1COc1ccccn1 33365915 NDKYFCXBUFCSCQ-FMCGGJTJSA-N 362.389 2.828 50 40 FFGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)CO/N=C(/N)c1ccc(F)cc1)C2 95348573 GSSPASYPGLNGNG-SPFAQBJXSA-N 360.433 2.781 50 40 FFGB Cc1ccc(N2C(=O)[C@@H]3[C@H](c4ccco4)C(C#N)=C(N)S[C@H]3C2=O)cc1 101304591 GHPDSTAHLAOERL-ARFHVFGLSA-N 365.414 2.671 50 40 FFGB COc1cc(/C=N/NC(=O)c2c[nH]c3ccccc23)cc(OC)c1OC 850933 GRJYGKHBLQXQCX-UFFVCSGVSA-N 353.378 2.958 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(F)cc1 4502862 RWFANUYLVBZBAC-AWEZNQCLSA-N 358.398 2.774 50 40 FFGB C[C@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)Cc1cccc(F)c1 10668016 OPCIDJPJVKOSIV-NSHDSACASA-N 372.425 2.626 50 40 FFGB O=C(N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21)c1ccccn1 18137179 FUCNBTHZCWBBHV-GFMRDNFCSA-N 370.412 2.805 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])ccc1OC(C)=O 408763087 RDGFIEXEKICJQQ-YBFXNURJSA-N 371.349 2.683 50 40 FFGB Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2Cl)cc1 7519514 JZZXVQGIKFWZEM-UHFFFAOYSA-N 359.234 2.925 50 40 FFGB CCc1ccc(CC(=O)N/N=C\c2cc(OC)cc([N+](=O)[O-])c2O)cc1 409361010 GIPWAAYPRKCNPN-ODLFYWEKSA-N 357.366 2.564 50 40 FFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)c1cccc(C)c1O 4303723 ARJGPJZXURMNHY-FYJGNVAPSA-N 355.394 2.844 50 40 FFGB CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)oc(=O)c32)cc1OC 4476330 BERBUCYSRUDUFN-QGZVFWFLSA-N 368.389 2.964 50 40 FFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1sccc1C 408906905 DZWIKGCXJJKYJI-UZUMKDMXSA-N 359.451 2.864 50 40 FFGB Cc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)ccc1N1CCOCC1 409244395 BWZHXIUKCNBLPU-HMAPJEAMSA-N 355.413 2.664 50 40 FFGB Cc1ccc([N+](=O)[O-])cc1N/C=C(/C#N)C(=O)NC(=O)Cc1ccccc1 2178892 BPFZHDLGZSXJJO-QINSGFPZSA-N 364.361 2.608 50 40 FFGB Cc1ccc(N2C(=O)[C@H](Cc3ccccc3)S/C2=C(/C#N)C(N)=O)cc1 934839 DTYCYFJWPQJJIS-IMGOXIFKSA-N 363.442 2.907 50 40 FFGB C[C@@H](OC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1)C(=O)NCc1ccco1 6831880 GYFDMPUSXUGRGN-DSQDWWTGSA-N 367.405 2.501 50 40 FFGB CC(C)=NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(C)cc1 59515872 YIWHHXNHURFRNM-UHFFFAOYSA-N 373.478 2.698 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc1 59433331 UPKTWZVJKXKRHK-WSDLNYQXSA-N 368.437 2.824 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(C)c(OC)c1 408608470 WMPIFFRSEPHEQH-HNNXBMFYSA-N 370.434 2.562 50 40 FFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc1 408980771 XHSKRMGXLWAHSX-MHWRWJLKSA-N 353.378 2.689 50 40 FFGB N#C/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)N1CCN(c2ccccc2)CC1 5590916 IEDBGCDQMYIDRT-LGMDPLHJSA-N 362.389 2.851 50 40 FFGB O=C(CNC(=O)c1ccccc1C(F)(F)F)N/N=C/c1cccs1 2451471 YABYOGQCKBQIBQ-DNTJNYDQSA-N 355.341 2.647 50 40 FFGB CCOC(=O)c1c(NC(=O)CCl)sc2c1CCN(C(=O)OCC)C2 4525115 LCZKKIPDFDLALT-UHFFFAOYSA-N 374.846 2.617 50 40 FFGB N#C/C(=C\N1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(F)cc1 20403638 ZTBSUKMLMZOWBC-FBMGVBCBSA-N 364.424 2.989 50 40 FFGB CN(CC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C(=O)OC(C)(C)C 12554141 HBRHUQRWWMSBKQ-UHFFFAOYSA-N 356.426 2.744 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)[C@H]2CCCc3ccccc32)cc1 24748548 VCHAJIYWSGMLOI-IBGZPJMESA-N 352.434 2.895 50 40 FFGB N#C/C(=C/c1ccccc1)C(=O)NNC(=O)c1ccc(Br)cc1 3305296 ZGYCJKFKUTWMRP-UVTDQMKNSA-N 370.206 2.817 50 40 FFGB COc1cc(/C(C)=N/NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1O 20158650 UWMAZXZMIADQEZ-RGVLZGJSSA-N 374.393 2.581 50 40 FFGB CC1(C)Cc2c(cnn2-c2ccccc2)C(=O)/C1=N\NC(=O)c1cccnc1 5093117 HWPVTGUXEMOTLE-LYBHJNIJSA-N 373.416 2.818 50 40 FFGB C/C(CC(=O)Nc1ccccc1)=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1 5287669 GFQQECKSSTUKTK-MOSHPQCFSA-N 354.366 2.658 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)ccc1OC 6155474 RJUPYGIJVDDUOI-UDWIEESQSA-N 355.394 2.816 50 40 FFGB COc1ccccc1OCC(=O)N/N=C(\C)c1cccc(NC(C)=O)c1 6303423 ISMCSWLMXJGRBK-FYJGNVAPSA-N 355.394 2.573 50 40 FFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1F 2638612 ZXJLHSLBBDPOBB-UHFFFAOYSA-N 357.168 2.973 50 40 FFGB O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1ccc2c(c1)OCCO2 2294240 PHMLBQFRUYRQSN-UFWORHAWSA-N 360.753 2.604 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCO2)=N\NC(=O)c1cccc(C)c1O 5101126 CEWNCYGLAYTDBL-CIAFOILYSA-N 369.377 2.564 50 40 FFGB CN1c2ccccc2C2=C([C@@H](c3ccsc3)C(C#N)=C(N)O2)S1(=O)=O 20558357 NBFOYQAHCSQBSB-AWEZNQCLSA-N 371.443 2.704 50 40 FFGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cccc([N+](=O)[O-])c1 408872284 CLIWQRVXFDLONN-OVCLIPMQSA-N 367.361 2.965 50 40 FFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1cc(Cl)ccc1O 409270992 SLMDNXQDSHZAEF-VXLYETTFSA-N 361.785 2.533 50 40 FFGB O=C(CCl)Nc1ccc(N2CCN(C(=O)c3ccccc3)CC2)cc1 585183659 DSKWEZBFYGBBOW-UHFFFAOYSA-N 357.841 2.826 50 40 FFGB O=C(N/N=C/c1ccccc1F)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 1089012 RKVNBTFWCGNVBD-RGVLZGJSSA-N 367.340 2.743 50 40 FFGB O=C(N/N=C/c1ccc(Sc2nnc[nH]2)c([N+](=O)[O-])c1)c1ccccc1 6889663 SILVODGGIXLBCH-GIJQJNRQSA-N 368.378 2.628 50 40 FFGB COc1cc(/C=N/NC(=O)[C@H]2[C@@H]3CCCC[C@]32C)c([N+](=O)[O-])cc1OC 100182285 KNHUWRAENMYBRW-QJPJNKPWSA-N 361.398 2.888 50 40 FFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc(OC)c1OC 2288986 DFKOPXRKBDNAIH-QGZVFWFLSA-N 353.378 2.513 50 40 FFGB biogenic,in-vitro COc1ccc(CSCC(=O)N/N=C/c2ccccc2C(=O)O)cc1 4508817 BXIGQUYJKPTBMM-VXLYETTFSA-N 358.419 2.777 50 40 FFGB N#C/C(=C/c1ccc([N+](=O)[O-])o1)C(=O)NCCc1c[nH]c2ccccc12 5007532 HPMKKDZZQQZXEQ-LCYFTJDESA-N 350.334 2.935 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccc2c(c1)OCO2 808850 ICSHLBYAACDPEA-INIZCTEOSA-N 360.325 2.740 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1oc2ccccc2c1COC(C)C 104472814 IBRYDUVGGSGQAM-OWBHPGMISA-N 356.378 2.840 50 40 FFGB COc1ccc(CCNC(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)cc1 1456714 RSBPONLGJZVQFS-MHWRWJLKSA-N 350.374 2.690 50 40 FFGB CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2cccnc2)N2NC=C(C#N)C2=N1 9423053 XVYDLFAHMUUYCM-LJQANCHMSA-N 370.416 2.984 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1ccccc1C(=O)c1ccccc1 14261018 NKEZQTTWQIEXDX-UHFFFAOYSA-N 358.397 2.921 50 40 FFGB COc1cc(SC)ccc1C(=O)NNC(=S)NCc1ccccc1 6447760 ZTNVKFXIAJIDAR-UHFFFAOYSA-N 361.492 2.726 50 40 FFGB C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@]3(C(=O)Nc4ccccc43)[C@H]2C1 4115159 SLCAPPSOGCMOQX-LBJGKRIESA-N 355.401 2.633 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1ccc([N+](=O)[O-])cc1 2462944 ZXLUSQUDUIRIPP-HNNXBMFYSA-N 360.329 2.654 50 40 FFGB CC1(C)C(=O)[C@@]2(Br)CC[C@]1(CC(=O)O)[C@H]2Br 109275417 OUDQDORDQBJHEI-PPKCKEKNSA-N 354.038 2.747 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1cccc(F)c1 100522743 HBZIAPMKPWBFHA-WSDLNYQXSA-N 371.368 2.731 50 40 FFGB O=C(CCc1c[nH]c2ccccc12)NNC(=S)NCc1ccccc1 2619543 RFZRZBIIYBGVPY-UHFFFAOYSA-N 352.463 2.796 50 40 FFGB C[C@@H](/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCO2 5920574 FJKRWAWDLZOEDJ-AINDZBIGSA-N 355.350 2.918 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)Cc1ccccc1 100522799 KRDYVWCESUMFAK-HYARGMPZSA-N 367.405 2.521 50 40 FFGB CCCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1Cl 59386537 VGSBGTLDOUNBQX-WSDLNYQXSA-N 373.840 2.895 50 40 FFGB C/C(=N\NC(=O)c1ccc(CN2CCOCC2)cc1)c1ccc(F)cc1 58915951 MZYKMNUKQONYTI-PXLXIMEGSA-N 355.413 2.812 50 40 FFGB N#C/C(=C/c1cc(O)ccc1[N+](=O)[O-])C(=O)Nc1cccc(C(=O)O)c1 107719610 ASXKOTDROMYZKA-SDQBBNPISA-N 353.290 2.544 50 40 FFGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1ccc(O)c(OC)c1 5267121 HGTVGJWXHDLNFG-CQSZACIVSA-N 372.402 2.776 50 40 FFGB Cc1cc(C)n(CC(=O)NNC(=O)[C@H](SCc2ccccc2)C(C)C)n1 65563040 YEBCWBQGINSAPJ-GOSISDBHSA-N 374.510 2.605 50 40 FFGB COc1ccc(/C=N\NC(=O)c2cc3ccccc3oc2=O)c(OC)c1 17299457 HNSDZTPELISQDI-JAIQZWGSSA-N 352.346 2.574 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2OC)ccc1OC(C)=O 408755038 PNGXKYQHAVUXQI-RGVLZGJSSA-N 356.378 2.701 50 40 FFGB C[C@@H](Oc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1)C(=O)O 33340231 GBZPMFWSRLXMCJ-RQNDZEIBSA-N 350.374 2.762 50 40 FFGB C/C(CN1C(=O)c2ccccc2C1=O)=N/NC(=O)c1cccc(Cl)c1 1082475 SJQDNPIRHKAPKW-JAIQZWGSSA-N 355.781 2.742 50 40 FFGB O=C(NNC(=O)[C@H]1CCCO1)c1ccc(-c2cccc(C(F)(F)F)c2)o1 32257862 BZUHCYXHQPBXBM-CYBMUJFWSA-N 368.311 2.905 50 40 FFGB CCn1c(NNC(=O)c2cc(Cl)ccc2OC)nc2ccccc2c1=O 9856909 SGKWKRZIGRRUJT-UHFFFAOYSA-N 372.812 2.835 50 40 FFGB C/C(=N\NC(=O)[C@H](C)Oc1ccc2c(c1)CCC2)c1cc(O)ccc1O 13321854 GKWFHHVYFUMMKW-XMOVILSBSA-N 354.406 2.894 50 40 FFGB CCOc1ccc(C(=O)N/N=c2/c(=O)c3cccc4cccc2c43)cc1OC 6788368 QENVVPMTVCWSSJ-BSYVCWPDSA-N 374.396 2.882 50 40 FFGB N#C/C(=C\c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1cccc([N+](=O)[O-])c1 409208010 DSTLPMIMEQUSIS-IZZDOVSWSA-N 354.278 2.754 50 40 FFGB N#CC1=C(N)Oc2[nH]c(=S)[nH]c(=O)c2[C@H]1c1c(Cl)cccc1Cl 5530634 YUCSMZFTRNURKS-MRVPVSSYSA-N 367.217 2.957 50 40 FFGB Cc1cccc(OCC(=O)N/N=C2\C(=O)N(C(C)C)c3ccccc32)c1 13582785 PUMJAXDIPWLWNB-QOCHGBHMSA-N 351.406 2.649 50 40 FFGB NC(=O)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 6220290 CMZRHNXCAOAEDE-GIDUJCDVSA-N 353.132 2.620 50 40 FFGB CC(C)NC(=O)/C(C#N)=C/c1cccc(/C=C(\C#N)C(=O)NC(C)C)c1 6429075 MSFLCLJBAZJWHC-BEQMOXJMSA-N 350.422 2.550 50 40 FFGB NS(=O)(=O)c1ccc(CNC(=O)CCCC[C@H]2CCSS2)cc1 61475986 UONDCGYCXKQFPL-ZDUSSCGKSA-N 374.553 2.664 50 40 FFGB biogenic O=C(NNC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)c1ccco1 28431247 HSVUHWCKDIHXQI-UHFFFAOYSA-N 364.405 2.944 50 40 FFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1c(C)nn(-c2ccccc2)c1C 2758355 UBLGKJQLYZSSPW-SFHVURJKSA-N 364.405 2.744 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2ccc(I)cc2)o1 408879777 FKZGLBWPUISTQK-OVCLIPMQSA-N 354.147 2.957 50 40 FFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)n(C)c2ccccc32)cc1 20086065 MFFUVSXDMCALTO-QGZVFWFLSA-N 359.385 2.765 50 40 FFGB Cc1ccc(S[C@@H](C)C(=O)NNC(=O)Cc2cn3ccsc3n2)cc1 9604154 IOWXGIMULTXFDX-LBPRGKRZSA-N 374.491 2.575 50 40 FFGB COc1cc(SC)ccc1C(=O)NNC(=O)COc1ccccc1C 2628731 YYNHKWMTZOROAA-UHFFFAOYSA-N 360.435 2.566 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1OC 409144849 PJRNCPDSEAXKEL-DEDYPNTBSA-N 356.378 2.923 50 40 FFGB Cc1c(C(=O)NNS(=O)(=O)c2cc(F)ccc2F)oc2ccccc12 8109794 DFTPXXQIVPYNGI-UHFFFAOYSA-N 366.345 2.643 50 40 FFGB CC1(C)CC(=O)C2=C(C1)N(c1nc[nH]n1)C(N)=C(C#N)[C@H]2c1ccccc1 8559530 NRGXTDBLDKCQKZ-MRXNPFEDSA-N 360.421 2.746 50 40 FFGB O=C(/C=C/c1cccc2ccccc12)NNC(=O)[C@H]1COc2ccccc2O1 10369147 JHQRJEBIHGHBIO-DRUFCSCSSA-N 374.396 2.840 50 40 FFGB CN(C)c1ccc(/C=N/NC(=O)CCNC(=O)c2ccccc2Cl)cc1 2675810 HBRPRQZHRJMWHU-LPYMAVHISA-N 372.856 2.676 50 40 FFGB CCC(=O)Nc1ccc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1 12137239 BXSZKMBIVOLEBL-UHFFFAOYSA-N 359.813 2.692 50 40 FFGB COc1ccc(OC)c([C@H]2NC(=O)NC(C)=C2C(=O)OCCCCl)c1 4064591 AWYCAOMTKLOVJI-OAHLLOKOSA-N 368.817 2.504 50 40 FFGB C/C(=N\NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O)C(C)(C)C 408780031 QMYCTGXICWOIMG-NBVRZTHBSA-N 353.488 2.608 50 40 FFGB CCCCc1[nH]nc2c1[C@H](c1cc(OC)cc(OC)c1)C(C#N)=C(N)O2 4631776 JEYFLEMDBMYOLV-MRXNPFEDSA-N 354.410 2.988 50 40 FFGB CCCN1C(=O)/C(=N\NC(=O)COc2cccc(Cl)c2)c2ccccc21 5739154 PHQCOAXSYFMKCV-PYCFMQQDSA-N 371.824 2.996 50 40 FFGB CCCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccc(Cl)cc1 408609202 JRCLMPSUDIXPOF-WSDLNYQXSA-N 373.840 2.895 50 40 FFGB COc1ccc(/C=N\NC(=O)COc2cccc(Cl)c2)cc1[N+](=O)[O-] 30802388 OYMWRAYVKVVLOT-NVMNQCDNSA-N 363.757 2.786 50 40 FFGB O=C(CC(=O)Nc1cccc(C(F)(F)F)c1)N/N=C/c1ccccc1O 1102852 OIVBKBGPORQKHZ-UFFVCSGVSA-N 365.311 2.890 50 40 FFGB Cc1ccccc1-n1ncc(C(=O)NNC(=O)c2ccco2)c1C1CC1 29737701 JFMPLPCDSJBJNH-UHFFFAOYSA-N 350.378 2.726 50 40 FFGB Cc1occc1C(=O)NNc1c([N+](=O)[O-])cc([N+](=O)[O-])c2cccnc12 12285102 CMEZSHURPGDRTL-UHFFFAOYSA-N 357.282 2.710 50 40 FFGB N#CC(C(=O)COC(=O)Cc1ccccc1F)=C1Nc2ccccc2N1 6017209 BNENBEHBGOQRHH-UHFFFAOYSA-N 351.337 2.753 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NCc2ccccc2)c(C)n1-c1ccccc1 408985006 KDQJPQASLRPFCU-BUVRLJJBSA-N 374.444 2.861 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)C)c2C)c(C)c1 2054008 IDFLKIFZGFUEIT-SRZZPIQSSA-N 354.454 2.686 50 40 FFGB Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NNC(=O)c1ccccc1O 7039129 RIYOKTKHUGAHCU-UHFFFAOYSA-N 370.796 2.615 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1 409248898 FWAIWYLLHWCVSZ-QQZPLFJDSA-N 365.433 2.815 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(Cl)cc3)CC2=O)cc1 33338153 UVCTUJUQMPLIHN-LRXPYSHVSA-N 371.824 2.852 50 40 FFGB CC(C)(C)[Si](C)(C)OC[C@@H]1CC[C@H](n2cnc3c(=O)[nH]cnc32)O1 195506181 UBDRNBJBRQIQCA-NWDGAFQWSA-N 350.495 2.819 50 40 FFGB C#CCOCCOCCOCCOCCSSc1ccccn1 952959953 QSFZYWOQKSZANQ-UHFFFAOYSA-N 357.497 2.522 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2ccc(F)cc2)cc1 16136988 DDTLDFBYALXEEE-LPYMAVHISA-N 357.385 2.898 50 40 FFGB C[C@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NNc1ccncc1 1467733 DWGHLAFUWNVXBL-INIZCTEOSA-N 374.444 2.862 50 40 FFGB CCn1c(SCC(=O)/C(C#N)=C(/C)N)nc2sc(C)c(C)c2c1=O 104421757 DRMPTRYIOMZFTC-LUAWRHEFSA-N 362.480 2.512 50 40 FFGB Cc1cc(/C=N/NC(=O)CC#N)c(C)n1-c1ccc(Cl)c(C(=O)O)c1 59140817 QCEAWYYEBDEUOE-AWQFTUOYSA-N 358.785 2.810 50 40 FFGB CC(C)CC(=O)NNC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1 10892847 PLTDEOLCDUDSNL-UHFFFAOYSA-N 369.450 2.803 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] 14186036 AKIXCPUFEFJXDP-RQZCQDPDSA-N 358.310 2.584 50 40 FFGB CC/C(=N\NC(=O)CSc1ncccn1)c1ccc(OC)c(OC)c1 16577089 GGURKHDQOHNRFH-DEDYPNTBSA-N 360.439 2.516 50 40 FFGB O=C(Cn1ccc(C(F)(F)F)n1)N/N=C/c1ccc(OC(F)F)cc1 33044076 UAXSHZWVTKVBMC-IFRROFPPSA-N 362.258 2.654 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cc2c(cc1Cl)OCO2 35253513 OCNHXNKAEFDFJS-LSCVHKIXSA-N 361.741 2.670 50 40 FFGB COc1ccc(/C=N/NC(=O)CC2(C)SCCS2)cc1[N+](=O)[O-] 6348146 LOXNCVIUEPRFIR-OQLLNIDSSA-N 355.441 2.640 50 40 FFGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccccc1C(=O)O 3209802 DFFKXQNKZCQVHA-LSFURLLWSA-N 365.311 2.966 50 40 FFGB Nc1ccccc1C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCCC1 59942102 DDQNAPMOPVGPJG-FYJGNVAPSA-N 367.409 2.931 50 40 FFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccccc2C(=O)O)c1 4657050 KXBPIJCOJKIEAU-UHFFFAOYSA-N 370.405 2.657 50 40 FFGB Cc1cc(Cl)ccc1O[C@H](C)C(=O)N/N=C1\N=C(N)c2ccccc21 16282795 KBSJFNFDTNUTPG-LLVKDONJSA-N 356.813 2.613 50 40 FFGB Cc1nn(CC(F)F)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253394149 ALOVFOQYWPVUEZ-OAHLLOKOSA-N 362.380 2.908 50 40 FFGB COc1cc(/C=N/NC(C)=O)ccc1OCc1nc2ccccc2nc1C 16265363 WOMXAWSNXUAWPU-SRZZPIQSSA-N 364.405 2.996 50 40 FFGB CC(C)OC(=O)COc1ccc(/C=N/NC(=O)c2ccccc2F)cc1 6327982 UISBIYIHDAAYBL-SRZZPIQSSA-N 358.369 2.920 50 40 FFGB CCOC(=O)/C(C#N)=C/c1ccc(Sc2nccn2C)c([N+](=O)[O-])c1 5267564 VUQDSVZDAMLIDL-XYOKQWHBSA-N 358.379 2.950 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2Cl)cc1 7869673 CYOWRFIQGBUZMU-UDWIEESQSA-N 357.797 2.994 50 40 FFGB N#C/C(=C\c1ccc(-n2cncn2)c(F)c1)C(=O)c1ccc2c(c1)OCO2 44028648 SZWHUSRACYPRDX-LHHJGKSTSA-N 362.320 2.925 50 40 FFGB COc1cc([N+](=O)[O-])cc(/C=C(/C#N)C(=O)Nc2ccccc2F)c1O 408824058 PEYUKMAVRHUGAH-WDZFZDKYSA-N 357.297 2.994 50 40 FFGB O=C(N/N=C/c1ccco1)c1nn(Cc2ccccc2)c(=O)c2ccccc12 7736605 KIISUSRBJXUSRE-LPYMAVHISA-N 372.384 2.802 50 40 FFGB CC(=O)Oc1cccc(/C=N/NC(=O)COc2cccc3cccnc23)c1 408760734 FDWGVZFGPRTLBC-WSDLNYQXSA-N 363.373 2.689 50 40 FFGB Cc1cc(C)cc(N2C(=O)C[C@@H](NNC(=O)c3ccc(Cl)cc3)C2=O)c1 96736621 LDEISLQNJQCYJJ-MRXNPFEDSA-N 371.824 2.523 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)CCc2c[nH]c3ccccc23)cc1 15890703 TWDUHQWFQCNGSN-UHFFFAOYSA-N 365.433 2.889 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)c2cc3cc(Cl)ccc3[nH]2)c1 32755041 YHXRWAXUIKCSEJ-UHFFFAOYSA-N 357.797 2.970 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)CCCOc2ccccc2)c1 6610221 QLLVYRJOOIPCAV-UHFFFAOYSA-N 356.422 2.689 50 40 FFGB COc1ccc(-c2nnc(SCC(=O)/C(C#N)=C(/C)N)n2C(C)C)cc1 103136462 JXXVPFNTZKOQGU-QINSGFPZSA-N 371.466 2.952 50 40 FFGB Cc1ccc(-c2n[nH]c3c2[C@]2(C(=O)Nc4ccccc42)C(C#N)=C(N)O3)cc1 5164041 VSAZDUXJBUUHFM-OAQYLSRUSA-N 369.384 2.710 50 40 FFGB COc1cccc(C(=O)N/N=C/c2ccc(N3CCOCC3)cc2C)c1 409075148 VHPUCPUJUSGUCF-KGENOOAVSA-N 353.422 2.604 50 40 FFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC3CCCC3)c2C)c1 408969763 UDDFLFKPQCJNPB-LPYMAVHISA-N 366.465 2.911 50 40 FFGB O=C(CNC(=O)c1ccccc1)N/N=C\c1ccc(Cl)cc1Cl 31729841 WBBDOILMNIMISL-UKWGHVSLSA-N 350.205 2.874 50 40 FFGB O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)c1ccc(O)nc1 10735587 HSPAAKRPVQCOIP-UHFFFAOYSA-N 357.366 2.730 50 40 FFGB O=C(CCNC(=O)c1ccccc1)NNc1c(F)c(F)c(F)c(F)c1F 14136324 OZFQQKJYEIXJTJ-UHFFFAOYSA-N 373.281 2.645 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC(C)(C)C)c(C)n1-c1ccccc1F 408970688 CAYCRJFGYVNTHO-SRZZPIQSSA-N 358.417 2.598 50 40 FFGB COc1ccc(OCCC(=O)NNC(=O)c2oc3ccccc3c2C)cc1 15941867 KYAMHMZCIISWBG-UHFFFAOYSA-N 368.389 2.980 50 40 FFGB O=C(N/N=C\c1ccc(Br)o1)c1ccc2c(c1)OCCO2 15989599 PFEWOUJKCIQNHM-PXNMLYILSA-N 351.156 2.577 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C/c1ccc(Br)o1 3068641 BVVVFGPLFCQGRJ-RQZCQDPDSA-N 367.199 2.970 50 40 FFGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 59515530 VEDXHVRZEIOXIK-FYJGNVAPSA-N 352.438 2.965 50 40 FFGB CC1=C(C)C[C@@H](C(=O)NNC(=O)c2cccc(Cl)c2)[C@H](C(=O)O)C1 5044981 YESXGRJZKOEVKU-ZIAGYGMSSA-N 350.802 2.548 50 40 FFGB N#CC1=C(O)NC(=O)[C@H]([n+]2ccc(-c3ccncc3)cc2)[C@H]1c1ccccc1 4729002 KXLKUXUEUYDJFN-VQTJNVASSA-O 369.404 2.784 50 40 FFGB CCn1c(NNC(=O)COc2ccc(Cl)cc2)nc2ccccc2c1=O 9857202 IMUNHQLYMBJWCN-UHFFFAOYSA-N 372.812 2.592 50 40 FFGB C[C@H]1CCc2sc(C(=O)NNC(=O)c3n[nH]c4ccccc34)cc2C1 8294855 MELOFINAUSRYKE-JTQLQIEISA-N 354.435 2.824 50 40 FFGB C/C(CC(=O)NNc1ccc([N+](=O)[O-])cc1)=N\Nc1ccc([N+](=O)[O-])cc1 16137177 KHKMDZKMUZEDKN-GZTJUZNOSA-N 372.341 2.824 50 40 FFGB C[C@@H](Br)C(=O)Nc1ccccc1C(=O)N1CCSCC1 2565071 QQCNEXLPXGKQGS-SNVBAGLBSA-N 357.273 2.598 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)c2nc3ccccc3c(=O)[nH]2)cc1 6564559 UREGWEWHTJTRDF-FYJGNVAPSA-N 363.421 2.533 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@H]2C[C@H]2c2ccccc2F)c2ccccc21 70019305 JKDYOPWTHRBKTK-GJZGRUSLSA-N 351.381 2.882 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)ccc1OCc1ccc(C)cc1 409251058 SUTWSORMHVHEEW-SXGWCWSVSA-N 365.389 2.685 50 40 FFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1ccc(Cl)cc1 409228149 URCJQGLZSPWFQU-FYJGNVAPSA-N 373.840 2.949 50 40 FFGB COc1cc(C(=O)CBr)ccc1I 169795977 OTXDYHIJFDRXBR-UHFFFAOYSA-N 354.969 2.877 50 40 FFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2cccc(C)c2O)cc1 5508972 CTJWWIZNHKVTNO-FYJGNVAPSA-N 355.394 2.844 50 40 FFGB O=C(CCSCCC(=O)NNc1ccccc1)NNc1ccccc1 1561891 SBJHKDJVSBLHAE-UHFFFAOYSA-N 358.467 2.786 50 40 FFGB O=C(N/N=C/C=C/c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 3140298 GOQSLHKSTNXCFX-PNDXKANYSA-N 353.334 2.795 50 40 FFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3cccs3)CC2=O)cc1 6963002 ZURXTVMTKWNBEJ-MDBUFAAASA-N 357.435 2.650 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)CC(=O)NC2CCCCC2)cc1OC 59516053 IOJYYSCJQOMTPA-KGENOOAVSA-N 373.453 2.549 50 40 FFGB CC1(C)[C@@]2(C(=O)O)CC[C@@]1(C)/C(=N/NC(=O)c1ccc(Cl)cc1)C2=O 100868681 PBDYJAHQGQMCFY-XENGFHBVSA-N 362.813 2.906 50 40 FFGB COc1ccccc1OCC(=O)N/N=C(\C)c1ccc(-n2ccnc2)cc1 6592034 LXLVGTXFCBEGDT-PXLXIMEGSA-N 364.405 2.800 50 40 FFGB CC(C)NC(=O)C(=O)N/N=C/c1ccccc1OCc1ccc(Cl)cc1 408607901 FNOOWHZWLLZNHZ-SRZZPIQSSA-N 373.840 2.894 50 40 FFGB CCCOc1ccc(C(=O)N/N=C\c2ccc(O)c(OC)c2)cc1OC 409311609 BJPPGRSPEQYOQV-NDENLUEZSA-N 358.394 2.962 50 40 FFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccccc1 408603814 HIXZWTXEQWMAPX-INIZCTEOSA-N 367.478 2.940 50 40 FFGB COc1ccc(OCC(=O)N/N=C\c2ccc(N3CCCC3)c(F)c2)cc1 409066517 LKTWOZGKJPAXRD-XKZIYDEJSA-N 371.412 2.964 50 40 FFGB Cc1cc(C(=O)NN[C@@H](C(N)=O)c2ccccc2)c(C)n1-c1ccccc1 26223722 YEAQAJNZEPZDAM-LJQANCHMSA-N 362.433 2.555 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1 3517575 GYFJRZBFIQFQEW-UHFFFAOYSA-N 368.311 2.797 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2cccc(Br)c2)cc1 6684553 MFVZAINQRCZSMX-VCHYOVAHSA-N 363.211 2.987 50 40 FFGB O=C(N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O)c1cccs1 4132804 XBXHZRGXPZTLJV-MKMNVTDBSA-N 370.184 2.888 50 40 FFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2COc3ccccc32)c1C 98052637 XBZFPNPZMWQFIO-GTENMVSRSA-N 365.433 2.908 50 40 FFGB C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(-n2ccnc2)cc1 5071416 QWFMXHJDJKEJDQ-KWJZBXMYSA-N 362.389 2.553 50 40 FFGB O=C(NNC(=O)[C@@H]1CCCO1)c1ccc(-c2cccc(C(F)(F)F)c2)o1 32257861 BZUHCYXHQPBXBM-ZDUSSCGKSA-N 368.311 2.905 50 40 FFGB O=C(NNC(=S)NC1CCCCC1)c1cccc(Br)c1 1440078 PMXUQMINAZIWKM-UHFFFAOYSA-N 356.289 2.891 50 40 FFGB Cc1ccc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c(C)c1 102612202 HNVOSKZUPCGDGB-BFUSDRCBSA-N 364.239 2.813 50 40 FFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc(F)cc3)CC2=O)cc1 6962980 AKQXKMXGBMXQTA-OOXYOOLHSA-N 369.396 2.728 50 40 FFGB O=C(CN1CCN(c2ccc3ccccc3n2)CC1)NN=C1CCCCC1 1445780 CFTOHVZEURAPCN-UHFFFAOYSA-N 365.481 2.793 50 40 FFGB N#CC(C#N)=C(NC1CC1)S[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O 215696744 AILJBUSPJMKIIU-CQSZACIVSA-N 372.837 2.716 50 40 FFGB Cc1nc(C)c(C(=O)N/N=C/c2cc(Br)ccc2O)s1 3173620 SMTCLIJPXXLZHV-GIDUJCDVSA-N 354.229 2.992 50 40 FFGB C/C(=N/NC(=O)c1ccco1)c1ccc(NC(=O)CCCC(=O)O)cc1 4507188 FCNWZIMYCAMOQT-NDENLUEZSA-N 357.366 2.627 50 40 FFGB Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C(\C#N)C(=O)N2CCOCC2)o1 408761131 IDLWTQJMUHDBLP-SDNWHVSQSA-N 367.361 2.929 50 40 FFGB O=C(CN1CCN(Cc2ccccc2Cl)CC1)N/N=C\c1ccccc1 32576971 BJQNCAYYHYFXPN-HMAPJEAMSA-N 370.884 2.608 50 40 FFGB Cc1nn([C@H](C)C(=O)N/N=C/c2ccc(F)s2)cc1Br 252494779 OENRODRGPAADOY-SDUWKLLGSA-N 359.224 2.866 50 40 FFGB COC(=O)c1ccc(I)cc1CBr 137998009 NOTJJRMYBQBRQJ-UHFFFAOYSA-N 354.969 2.973 50 40 FFGB CN(C)c1ccc(/C=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)o1 15987920 PPUHUSCGXXVWIA-JCMHNJIXSA-N 363.417 2.732 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1 8237889 PNPKDGPMBFTJCF-UHFFFAOYSA-N 363.373 2.915 50 40 FFGB C/C(CC(=O)Nc1cccc(C(F)(F)F)c1)=N\NC(=O)c1cnccn1 100510220 JVFXKWTVNMLMKA-AUEPDCJTSA-N 365.315 2.630 50 40 FFGB O=C(NNC(=O)c1nccc2ccccc12)c1cc(-c2ccccc2)on1 63501619 PVQARMVGIRUMBW-UHFFFAOYSA-N 358.357 2.965 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)NNC(=O)/C=C/c2cccs2)cc1C 6480288 IRDMTESJROBVOM-BQYQJAHWSA-N 371.462 2.944 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1ccccc1NC(=O)c1ccccc1 408998858 SKXUMJRUWDWVOD-UHFFFAOYSA-N 373.412 2.943 50 40 FFGB C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCl 408738636 SWIBMCYWVIHRME-ZFWWWQNUSA-N 370.877 2.840 50 40 FFGB COc1ccc(/C=N\NC(=O)c2c(C)nc3cc(C)ccn23)cc1OC 32125470 RDROIRDZYXPNNP-JAIQZWGSSA-N 352.394 2.732 50 40 FFGB CC(C)=C1[C@@H]2CC[C@@H]1[C@@H](C(=O)NNC(=O)c1sccc1C)[C@@H]2C(=O)O 226356588 FCUZTBBHXJMZQL-CDGCEXEKSA-N 362.451 2.511 50 40 FFGB CCN(CC)C(=O)Cn1cc(/C=C(\C#N)C(=O)NC2CC2)c2ccccc21 890565 JSPVGSQSYJFKTN-RVDMUPIBSA-N 364.449 2.695 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)ccc1O[C@@H](C)C(=O)O 4545779 PDPYGSNCQMAQDU-OJNRTJSBSA-N 372.421 2.903 50 40 FFGB CCCc1ccc(OCC(=O)NNC(=O)COc2ccccc2C)cc1 1801248 FPSWPGBIIROWNU-UHFFFAOYSA-N 356.422 2.553 50 40 FFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2)nc2ccccn2c1=O 2423966 BLRNJROHPPNGER-WYMLVPIESA-N 360.373 2.530 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 4696453 LAICFDZUHJPPEX-KGENOOAVSA-N 353.422 2.584 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(SC)cc1 408604346 IFZVZPWBKJPKOA-AWEZNQCLSA-N 372.475 2.966 50 40 FFGB Cc1occc1C(=O)NNC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 50098484 CSXNUXZXIMVIPA-OAHLLOKOSA-N 363.801 2.669 50 40 FFGB O=C(NN1C(=O)[C@H](Cl)[C@@H]1c1cccc(Cl)c1)c1ccccc1O 1633515 GVALIQHSELKKKI-KGLIPLIRSA-N 351.189 2.881 50 40 FFGB COc1ccc(/C=C(/C#N)C(N)=O)cc1COc1ccc(C)cc1[N+](=O)[O-] 17075401 QLTLTNVYJBRNCC-ZSOIEALJSA-N 367.361 2.883 50 40 FFGB O=C(N/N=C/c1ccc(CN2CCCCC2)o1)c1cc([N+](=O)[O-])ccc1O 409142221 CJBKQDBOVKBFJP-YBFXNURJSA-N 372.381 2.643 50 40 FFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccc(Br)s1 866587 JSYINMWGVJATLE-LLVKDONJSA-N 355.213 2.765 50 40 FFGB COc1cc2c(cc1OC)[C@H]1C/C(=N/NC(N)=O)[C@H](CC(C)C)CN1CC2 105261151 UZYMRVUJWGYPGN-ITGFUDAMSA-N 374.485 2.693 50 40 FFGB Cc1ccc(O[C@@H](C)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1 7990085 FOJJAZMNJJNYGC-INIZCTEOSA-N 356.422 2.606 50 40 FFGB C[C@H](NC(=O)C(=O)N/N=C/c1c(O)ccc2ccccc12)c1ccccc1 4409126 OGRIBPGJCFOLME-KOUDTOEKSA-N 361.401 2.873 50 40 FFGB Cc1cccc(OCC(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2O)c1 5602839 GSHDYJCWPZIWAZ-CIAFOILYSA-N 364.405 2.724 50 40 FFGB O=C(O)/C=C\C(=O)N/N=C(\c1ccccc1)c1ccc(Br)cc1 16450739 YNCBQWBCWCWAAW-ZVDZJOMHSA-N 373.206 2.959 50 40 FFGB C[C@@H](Oc1ccc(/C=C(\C#N)C(=O)NCc2ccccc2)cc1)C(=O)O 2237655 GBZPMFWSRLXMCJ-SWEABUAFSA-N 350.374 2.762 50 40 FFGB CC[C@H](C)c1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccco2)CC1=O 12926499 URURFYZFMNUGQA-UONOGXRCSA-N 369.421 2.607 50 40 FFGB CC(C)Oc1c(Br)cc(C(=O)NN)cc1Br 98087291 ZEFNECYFNZQXIN-UHFFFAOYSA-N 352.026 2.602 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)c2ccc(OC(F)(F)F)cc2)c1 5272952 OXKFNSYRAJVCSG-UHFFFAOYSA-N 368.311 2.734 50 40 FFGB O=[N+]([O-])c1ccc(SSCCCOP(=O)(O)O)c([N+](=O)[O-])c1 22058161 AWNKTODOBIDEPS-UHFFFAOYSA-N 370.301 2.743 50 40 FFGB in-vitro CC1=C(C(=O)OCCCl)[C@@H](c2ccccc2OC(C)C)NC(=O)N1 4492353 FIRXBXPGVJVJEE-OAHLLOKOSA-N 352.818 2.884 50 40 FFGB O=C(N/N=C/c1ccncc1)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 409007237 VVZZVHJMPPXXEM-LPYMAVHISA-N 370.840 2.738 50 40 FFGB Cc1cc(C)nc(NNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)n1 13012913 SFSOGOBOISQOLZ-UHFFFAOYSA-N 366.400 2.664 50 40 FFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccccc2O)c1 116740582 VZZROTBYCBPALB-CAOOACKPSA-N 365.183 2.633 50 40 FFGB CCOc1cc(/C=N/NC(=O)COc2ccccc2OCC)ccc1O 5467316 KUPAPXXEWGICDE-UDWIEESQSA-N 358.394 2.719 50 40 FFGB Cc1ccc(OCC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1 4700076 DYTHBUSMODVHCW-UHFFFAOYSA-N 370.449 2.898 50 40 FFGB N#Cc1ccc(C(=O)N/N=C/c2ccc(O)c(Br)c2)c(F)c1 408964811 FBMAAUSSHQCNML-UFWORHAWSA-N 362.158 2.929 50 40 FFGB O=C(N/N=C\c1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(Cl)cc1 31637159 VKIHCVACQCOVEO-KFSYKRRRSA-N 363.204 2.594 50 40 FFGB O=C(CSc1nnc(NC(=O)CCCl)s1)Nc1ccccc1 2451521 JTLYINKUSBHVGP-UHFFFAOYSA-N 356.860 2.836 50 40 FFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2Cl)cc1 4113749 SGGAMNHFNPMQIY-WSDLNYQXSA-N 371.824 2.671 50 40 FFGB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)NNC(=O)c1sccc1C)[C@@H]2C(=O)O 17074569 FCUZTBBHXJMZQL-OIMNJJJWSA-N 362.451 2.511 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccc([N+](=O)[O-])s1 1830788 IDMGEJZKKITHKR-CYBMUJFWSA-N 367.342 2.981 50 40 FFGB COc1c(OC(C)=O)ccc(/C=N/NC(=O)Nc2ccccc2)c1[N+](=O)[O-] 809186 KAJJNUCIRNAVDW-VCHYOVAHSA-N 372.337 2.684 50 40 FFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2cccs2)c1 408590887 RCSSWCGTNWUFKX-VIZOYTHASA-N 355.213 2.989 50 40 FFGB Cc1ccc(NCC(=O)N/N=C/c2ccc(O[C@@H](C)C(=O)O)cc2)cc1C 408855994 PADCSGVGEQDMSJ-URMYYVDKSA-N 369.421 2.718 50 40 FFGB O=C(NNc1ccc([N+](=O)[O-])cn1)Nc1ccc(Br)cc1 17302445 ZSMLDPVBGWBBHF-UHFFFAOYSA-N 352.148 2.901 50 40 FFGB COc1ccc(Nc2cc[nH]c(=O)n2)cc1CN(CCCl)CCCl 1696745 HGSLJAICSCHIJU-UHFFFAOYSA-N 371.268 2.802 50 40 FFGB CC[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccccc1 7647226 SVQAMXAURAUBEU-INIZCTEOSA-N 374.824 2.838 50 40 FFGB Cc1cc(Br)ccc1SCC(=O)NNC(=O)c1ccco1 6786583 VFAJWCCIXNSBLI-UHFFFAOYSA-N 369.240 2.904 50 40 FFGB O=C(NNC(=O)c1ccccc1O)c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 17526315 POLAZYDQCLIPAA-UHFFFAOYSA-N 367.317 2.635 50 40 FFGB CNS(=O)(=O)c1ccc(N/C=C(/C#N)c2nc3ccccc3o2)cc1 5334846 SIRQMXIDWNQLRC-QXMHVHEDSA-N 354.391 2.712 50 40 FFGB NNC(=O)c1ccc(OC(=O)c2ccc(Cl)cc2)c(Br)c1 226307089 ZIKMJIIRBJIJCP-UHFFFAOYSA-N 369.602 2.925 50 40 FFGB CN(C)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1 7496488 POGFSHSUZJJJRN-KRWDZBQOSA-N 358.401 2.812 50 40 FFGB N#C/C(=C\c1c(Oc2ccc(Cl)cc2)nc2ccccn2c1=O)C(N)=O 2413588 HVKMMKAQMCNSKQ-PKNBQFBNSA-N 366.764 2.532 50 40 FFGB COc1cccc(/C=N/NC(=O)c2ccc(C)cc2)c1O[C@H](C)C(=O)O 409243353 VVSZHLBOMLVXSI-AYPRBGQRSA-N 356.378 2.619 50 40 FFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3sccc3C)CC2=O)cc1 2263646 HYMJDFHNDNPPAK-HXJASHHUSA-N 371.462 2.958 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc(OC)c(OC)c2)cc1 9060676 DZRNWMFQUZQCLP-FOWTUZBSSA-N 374.418 2.963 50 40 FFGB O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1ccoc1 13001470 JJIOBQMVLQJSKR-UHFFFAOYSA-N 366.373 2.699 50 40 FFGB COc1ccc(Br)cc1/C=C(\C#N)C(=O)NC[C@H]1CCCO1 6209743 HZNBUMQANXATTI-WEKMIXOTSA-N 365.227 2.660 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)c2cc([N+](=O)[O-])ccc2OC)c1 408589649 MJAVTDJATDVKPK-XDHOZWIPSA-N 355.350 2.932 50 40 FFGB N#C/C(=C/c1ccc(-c2cccc(Br)c2)o1)C(=O)NC(N)=O 409232881 IWGQCXCOZFKYHG-YFHOEESVSA-N 360.167 2.811 50 40 FFGB CCOC(=O)CSC1=C(C#N)[C@H](c2cccc(Cl)c2)CC(=O)N1 9015128 WEJYFOVCOKIWNP-LBPRGKRZSA-N 350.827 2.975 50 40 FFGB COc1ccc2c(c1)nc(SCC(=O)N/N=C/c1cccs1)n2C 998281 WBSWNDKJKSDBJO-RQZCQDPDSA-N 360.464 2.886 50 40 FFGB Cc1noc(C)c1COc1ccccc1C(=O)NNC(=O)NC1CCCC1 65919724 XFVYXNMYCKQNFO-UHFFFAOYSA-N 372.425 2.757 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])cc(Br)c2O)o1 409038985 QECQMSATSLMHAD-GIDUJCDVSA-N 368.143 2.728 50 40 FFGB OC[C@@H](I)CC(F)(F)C(F)(F)Br 80440341 NAXMYDUMZNNYCA-VKHMYHEASA-N 364.902 2.795 50 40 FFGB CC1(C)C(=O)[C@]2(Br)CC[C@@]1(CC(=O)O)[C@@H]2Br 85398921 OUDQDORDQBJHEI-XROYCOCOSA-N 354.038 2.747 50 40 FFGB CCOC(=O)c1c(C)[nH]c(/C(C)=N/NC(=O)CNc2ccccc2)c1C 6297651 FHYUYHUWZWFBNV-HYARGMPZSA-N 356.426 2.761 50 40 FFGB N#C/C(=C/c1cccnc1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 2708581 LYRNQDYGAQPHPF-WQLSENKSSA-N 352.419 2.666 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cc([N+](=O)[O-])ccc1Cl 35175862 MZKZJZZWXZUNBM-MFOYZWKCSA-N 362.729 2.849 50 40 FFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1cc[n+](Cc2ccccc2)cc1 825271 WPBVZDPETMEQTA-UHFFFAOYSA-O 360.393 2.515 50 40 FFGB O=S1(=O)C[C@@H](Cl)[C@@H](OC(Cl)(Cl)C(Cl)(Cl)Cl)C1 12175823 BADYEMQWKWXDSG-DMTCNVIQSA-N 370.896 2.909 50 40 FFGB O=C(/C=C/c1ccccc1)NC(=S)NNC(=O)c1ccc(Cl)cc1 5680489 IPUZVKHNZNQRLD-IZZDOVSWSA-N 359.838 2.689 50 40 FFGB N#C/C(=C/c1ccccc1)C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-] 6251931 YFERJKKYOVSNTP-UVTDQMKNSA-N 351.318 2.684 50 40 FFGB CCc1ccc(NC(=O)C(=O)N/N=C(\C)CC(=O)NC2CCCCC2)cc1 4416628 WHXOKRQSSQYHEE-OEAKJJBVSA-N 372.469 2.519 50 40 FFGB COc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2OC)cc1 971318 PIAIENDWMZHDOD-FYJGNVAPSA-N 364.405 2.962 50 40 FFGB CC(C)(C)CC(=O)NNC(=O)Cn1c(C(F)(F)F)nc2ccccc21 12582587 CNRYPQBTCPTXJU-UHFFFAOYSA-N 356.348 2.639 50 40 FFGB COc1cc2cc(C(=O)N/N=C/c3cccc(OC)c3O)[nH]c2cc1OC 2225599 SZJIVDKCXTTZCG-KEBDBYFISA-N 369.377 2.663 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1ccc(Br)cc1F 13000354 NKDYZNGKMKEPQS-UHFFFAOYSA-N 351.175 2.592 50 40 FFGB CC(C)c1n[nH]c(SCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)n1 9221187 NZDJDRVOVOPRBF-UHFFFAOYSA-N 368.466 2.911 50 40 FFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=O)c2ccccc2C)cc1 5873467 BORSSTPGRKQPGG-UHFFFAOYSA-N 369.421 2.574 50 40 FFGB O=C(NNc1c(F)c(F)c(F)c(F)c1F)c1cnn(-c2ccccc2)n1 9447357 XXZVTYMXJYFQKZ-UHFFFAOYSA-N 369.253 2.720 50 40 FFGB CC(C)NC(=O)/C(C#N)=C/c1ccc(OCC(=O)NC2CCCCC2)cc1 408817399 TWHRZAGXXHLOAP-SFQUDFHCSA-N 369.465 2.946 50 40 FFGB COc1ccc(C(=O)N/N=C\c2cc(Br)c(O)cc2O)cc1 83260165 XWAMHSWFPMEXBI-IUXPMGMMSA-N 365.183 2.633 50 40 FFGB CCOC(=O)CSC1=C(C#N)C(=O)N[C@@H](c2ccc(OC)cc2)S1 1240897 WOFOIZGCAFPWJD-OAHLLOKOSA-N 364.448 2.588 50 40 FFGB CC(C)c1nc(SCC(=O)/C(C#N)=C2/Nc3ccccc3N2C)n[nH]1 105076490 IHZABKXNOLVURG-WJDWOHSUSA-N 354.439 2.886 50 40 FFGB COc1ccc(CC(=O)N/N=C/C=C/c2ccc3c(c2)OCO3)cc1OC 2293683 PRROCEQHCMIAAZ-XCPVHJTNSA-N 368.389 2.790 50 40 FFGB O=C(N/N=C(/CNNC(=O)c1ccccc1)c1ccccc1)c1ccccc1 6593588 LWLGSOLZNLZCJR-GFMRDNFCSA-N 372.428 2.755 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc[nH]n2)cc1CSc1ccccn1 15895105 MZUWLSVORLNYBL-SRZZPIQSSA-N 367.434 2.870 50 40 FFGB N#C/C(=C1/CCCCN1)S(=O)(=O)c1ccc(Br)cc1F 98212085 HTNBHFBHQXNJML-ACCUITESSA-N 359.220 2.871 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1c(O)ccc2ccccc12 1051257 XJCVNNCVTGHWKI-RGVLZGJSSA-N 365.345 2.983 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2cc(F)c(F)cc2Cl)c1 3358952 TZAVMMQIVLOVDK-UHFFFAOYSA-N 370.739 2.710 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2ccc(OC)cc2)cc1 4551370 HOFKFAVAPMSPGH-HYARGMPZSA-N 369.421 2.767 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)N2CCCC2)c(C)n1-c1ccc(Cl)cc1 408985355 LNZXJUCPNCILQJ-CIAFOILYSA-N 372.856 2.820 50 40 FFGB CCOc1cc(/C=N\NC(=O)Cc2ccc(CC)cc2)cc([N+](=O)[O-])c1O 409364308 OYVZTIAGDAIGKW-NDENLUEZSA-N 371.393 2.954 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cc1OC 33668089 MKSNYSQLDZHGTL-UDWIEESQSA-N 355.394 2.816 50 40 FFGB O=C(CCl)N(c1cccc(Cl)c1Cl)[C@@H]1CCS(=O)(=O)C1 40177626 BGHBFIFIGBEWBD-MRVPVSSYSA-N 356.658 2.752 50 40 FFGB C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(C(=O)O)s1 5516984 IRWVUGVBJUIHCL-MKMNVTDBSA-N 357.185 2.956 50 40 FFGB Cc1cc(=O)c2c(o1)OC(N)=C(C#N)[C@@H]2c1ccc(Br)cc1 1073588 LGKXNJAWUBNXRJ-ZDUSSCGKSA-N 359.179 2.929 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)O)c(Cl)c2)cc1 59303181 ABKWHNFXWDNVFA-DJKKODMXSA-N 362.769 2.576 50 40 FFGB COc1ccc(N/C=C2\C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)cc1OC 9423441 IVVKZWXZNBKKHY-YBEGLDIGSA-N 369.421 2.864 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)CNC2CCCCC2)cc1[N+](=O)[O-] 409378551 PZXXSIKUQOBAJC-DEDYPNTBSA-N 362.430 2.756 50 40 FFGB O=C1C=C(NNC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)C1 5684868 DGDZTEPFAZRGBT-INIZCTEOSA-N 365.389 2.789 50 40 FFGB CSc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 8169582 JIFZWZYGFNXEDQ-SLDJAQPHSA-N 353.447 2.912 50 40 FFGB COc1cc(/C=N/NC(=O)COc2cccc(Cl)c2)cc(OC)c1O 1445170 GXIIARKBLAQAGH-DJKKODMXSA-N 364.785 2.592 50 40 FFGB CCC(=O)N1CCN(c2ccccc2[C@H]2C[C@@H](C(=O)Cl)CC2=O)CC1 57328021 RZXGKWKGMYYWGI-UKRRQHHQSA-N 362.857 2.573 50 40 FFGB C/C(=N/NC(=O)c1ccc2c(c1)OCO2)c1cccc(NC(=O)C2CC2)c1 5381298 AKIXRXMMMKPJEB-UUYOSTAYSA-N 365.389 2.918 50 40 FFGB O=C(N/N=C/c1ccc(OC2CSC2)cc1)c1cccc([N+](=O)[O-])c1 408879316 DDTDCHWNOFDYHU-GIJQJNRQSA-N 357.391 2.853 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(Cl)cc2)c(O)c([N+](=O)[O-])c1 409371376 IGAYAAVXZPWRPH-GIJQJNRQSA-N 363.757 2.655 50 40 FFGB Cc1ccc(/C=N/NC(=O)CNC(=O)c2ccccc2Br)cc1 2675693 QXDDBJRNUFEBPE-KEBDBYFISA-N 374.238 2.638 50 40 FFGB N#CSc1ccc(N/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)cc1 4797919 WOLYENPGZWPSSR-GDNBJRDFSA-N 364.386 2.839 50 40 FFGB CCOc1cc(/C=N/NC(=O)[C@H]2[C@H]3CCCC[C@]23C)cc([N+](=O)[O-])c1O 100302423 CAZHQBFCYZCVHJ-IFTAUCRASA-N 361.398 2.976 50 40 FFGB O=C(c1ccccc1)c1nn(-c2ccccc2)cc1/C=N/NC(=O)C1CC1 3320773 TUXRZEONUOHIMJ-LPYMAVHISA-N 358.401 2.963 50 40 FFGB COc1ccc(CN(C)C(=O)NNC(=O)c2ccc(C)s2)cc1F 63200900 UGDCQSIABXYIBF-UHFFFAOYSA-N 351.403 2.691 50 40 FFGB Cc1ccsc1/C=N/NC(=O)CNC(=O)c1c(F)cccc1Cl 4086385 XCMLXGMXDBNATL-FBCYGCLPSA-N 353.806 2.729 50 40 FFGB COc1cc(/C=N/NC(=O)[C@H]2[C@H]3CCCC[C@@]23C)c([N+](=O)[O-])cc1OC 5920254 KNHUWRAENMYBRW-CLZUWWFZSA-N 361.398 2.888 50 40 FFGB CCCN1C(=O)/C(=N/NC(=O)CNc2ccc(C)cc2)c2ccccc21 100827364 OSRBFSYNYHLYAC-FCDQGJHFSA-N 350.422 2.684 50 40 FFGB O=C(CN1CCCC1=O)N/N=C1/C[C@H](c2ccccc2)Oc2ccccc21 84525296 LYTQDIZOTHOTGK-YQPBSLOJSA-N 363.417 2.653 50 40 FFGB CC(C)Oc1ccc(C(=O)NNS(=O)(=O)/C=C/c2ccccc2)cc1 14252746 VDXPGUKHYVQOAV-OUKQBFOZSA-N 360.435 2.709 50 40 FFGB CCOC(=O)COc1cccc(/C=N/NC(=O)c2ccc(OCC)cc2)c1 20764602 HJKIFWKPRURMLL-FYJGNVAPSA-N 370.405 2.791 50 40 FFGB COc1ccccc1/C=N/NC(=O)[C@H]1CC(=O)N(c2ccc(C)c(C)c2)C1 409170046 SBBWRJFLUXXCAQ-QQZPLFJDSA-N 365.433 2.815 50 40 FFGB O=C(NNC(=O)c1ccccc1C(=O)O)c1ccc(Cl)cc1Cl 670499 VVCQVBJSIZTRAE-UHFFFAOYSA-N 353.161 2.766 50 40 FFGB CC(C)[C@@H](C(=O)NNC(=O)C1CCCC1)n1cnc2cc(F)c(F)cc21 61382387 XQGBDLVIDSIEOB-INIZCTEOSA-N 364.396 2.849 50 40 FFGB O=C(N/N=C/c1ccccc1OCc1ccccc1)C(=O)NC1CCCC1 59515582 IXPOXQSVYWQWGD-HYARGMPZSA-N 365.433 2.775 50 40 FFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)[C@H](OC)c1ccccc1 100285453 TZGGRRJZFANTNJ-VZMFNRANSA-N 369.421 2.904 50 40 FFGB CCNC(=O)/C(C#N)=C/c1c(Oc2cccc(C)c2)nc2ccccn2c1=O 2420142 HFOJIGYFGOWCLL-NTCAYCPXSA-N 374.400 2.838 50 40 FFGB CN1C(=O)[C@]2(C(C#N)=C(N)Oc3c2ccc2cccnc32)c2ccccc21 524732463 FZMUMMBNOOMAQS-OAQYLSRUSA-N 354.369 2.584 50 40 FFGB CC(C)(C)[Si](C)(C)OC[C@H]1CC[C@@H](n2cnc3c(=O)[nH]cnc32)O1 195506179 UBDRNBJBRQIQCA-NEPJUHHUSA-N 350.495 2.819 50 40 FFGB CC/C(=N\NC(=O)CCC(=O)NCc1ccccc1)c1ccc(O)cc1 19799084 UVBISUAIXKWGDB-RELWKKBWSA-N 353.422 2.719 50 40 FFGB CN1C(=O)/C(=N\NC(=O)CNc2ccc3ccccc3c2)c2ccccc21 18137753 GDCAYGRJSYCZAE-GFMRDNFCSA-N 358.401 2.749 50 40 FFGB COc1ccccc1/C=C(/C#N)C(=O)NCCc1ccc(OC)c(OC)c1 3328698 ZQBJCWGKMURJJN-LGMDPLHJSA-N 366.417 2.978 50 40 FFGB O=C(N/N=C/c1ccc(Cl)cc1)c1nc(O)c2cc([N+](=O)[O-])ccc2n1 13865657 OTNVYEXDICMQNE-QGMBQPNBSA-N 371.740 2.661 50 40 FFGB Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)CCc1ccccc1 9467393 YUBZPDCFIGKOQX-AWEZNQCLSA-N 365.437 2.608 50 40 FFGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)COc1ccc(Cl)cc1 218740394 PREMWLWRGHIYII-UHFFFAOYSA-N 357.797 2.926 50 40 FFGB CC(C)NC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2Cl)c1 8218460 NGGUGNDQDNHPJI-SRZZPIQSSA-N 373.840 2.894 50 40 FFGB COc1ccc(C)cc1S(=O)(=O)NNC(=O)c1oc2ccccc2c1C 7423306 HWWVNDPQRDPTNK-UHFFFAOYSA-N 374.418 2.682 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(O)c(O)c2)cc1Br 1434209 FFESYBAVPDIOBT-CAOOACKPSA-N 365.183 2.633 50 40 FFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@H]1c1cccc(Br)c1 57509027 RNCKZAGASHSSEG-LBPRGKRZSA-N 373.634 2.859 50 40 FFGB Cn1c(SCC(=O)N/N=C/c2cccs2)nnc1-c1ccccc1 2319200 LAUWHYQIGLISGD-LICLKQGHSA-N 357.464 2.786 50 40 FFGB O=C(NNc1ccc(Cl)nn1)N[C@@H]1CCCOc2ccc(F)cc21 65547044 GKOIQUCOTFTPFR-LLVKDONJSA-N 351.769 2.809 50 40 FFGB C/C(Cc1ccccc1)=N/NC(=O)CSc1nnc(-c2ccncc2)o1 4591099 UXQRLOOWSXQTNP-MOSHPQCFSA-N 367.434 2.959 50 40 FFGB CC(C)Oc1ccc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)c(O)c1 408590834 QRRSQZSYRBSJPE-YBFXNURJSA-N 357.366 2.780 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC(C)C)c(C)n1-c1ccccc1Cl 2054010 AXMKBCRBTDXSSQ-KEBDBYFISA-N 360.845 2.722 50 40 FFGB COc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c(OC)c1C 8336678 HXXWEJCKNXDQQD-DJKKODMXSA-N 374.466 2.661 50 40 FFGB Cc1cc(C(=O)N/N=C/c2cc(Br)cc(Cl)c2O)[nH]n1 4550051 GLWKYBJHKLISCD-PJQLUOCWSA-N 357.595 2.604 50 40 FFGB O=C(N/N=C/c1ccc(Br)cc1)C(=O)Nc1cccc(F)c1 3151145 KRHXJUHYUQKXHZ-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB CCOc1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)ccc1OCC(N)=O 6960627 OAUNBPWNXSMDSR-DHDCSXOGSA-N 367.361 2.922 50 40 FFGB CCOc1c(Br)cc(/C=N/NC(N)=O)cc1Br 7894823 YKNAXPGQIHZJAF-LHHJGKSTSA-N 365.025 2.613 50 40 FFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCC(=O)c2cccs2)c1C 6983904 INDAORHFZFBRLV-CQSZACIVSA-N 374.462 2.943 50 40 FFGB O=C(CCc1ccc2c(c1)OCO2)NNC1=C(C(=O)C(F)(F)F)CCC1 408564342 YPMGYGLOXBYRRF-UHFFFAOYSA-N 370.327 2.538 50 40 FFGB CC(C)[C@@]12N=C(O)[C@@](C#N)(C(C#N)=C(I)N1)C2(C)C 66088015 DFCFPXHEGWFHHM-OLZOCXBDSA-N 370.194 2.618 50 40 FFGB C/C(=N\NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 408863539 NHQUWRCWZFPTOQ-XDHOZWIPSA-N 355.350 2.828 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)COc2ccccc2OC)cc1OC 3168959 KSTPAPPLQGGYDB-FYJGNVAPSA-N 370.405 2.798 50 40 FFGB NC(=O)COc1ccc(/C=N\NC(=O)c2ccc(-c3ccccc3)cc2)cc1 32578322 REMBLIRVWWMSOX-OYKKKHCWSA-N 373.412 2.982 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)CSc2ncccn2)cc1OCC 6783987 KUZPYJKJSKULQR-CIAFOILYSA-N 372.450 2.683 50 40 FFGB CCOc1ccccc1OCC(=O)NN=C(CCC(=O)O)c1ccccc1 245204260 JBLRUELRAORVSA-UHFFFAOYSA-N 370.405 2.849 50 40 FFGB O=C(CN1CCCCC1)N/N=C/c1ccc(OC(=O)c2ccccc2)cc1 831199 NIMQOCRBDKNURO-PXLXIMEGSA-N 365.433 2.842 50 40 FFGB CC[C@@H](C)NC(=O)C/C(C)=N/NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 4402171 JZICTIRQIQRTQI-MPFKWURBSA-N 354.794 2.659 50 40 FFGB COc1ccc(OC)c(NC(=O)C/C(C)=N/NC(=O)c2ccccc2O)c1 100843246 JRNXMWLQHNREPO-CIAFOILYSA-N 371.393 2.544 50 40 FFGB Cc1ccccc1NC(=O)NNC(=O)CCCn1c(=O)oc2ccccc21 32928447 DSKNZMAWLSDKMZ-UHFFFAOYSA-N 368.393 2.536 50 40 FFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1 3088312 QNRGGIXGPUPPPY-UFFVCSGVSA-N 365.311 2.803 50 40 FFGB N#C/C(=C\c1ccc2c(c1)OCO2)C(=O)N1CCN(c2ccccc2)CC1 1097450 NCZCTPQIMWTVLN-SFQUDFHCSA-N 361.401 2.671 50 40 FFGB Cc1cc(/C=N/NC(=O)CC2(C)OCCO2)c(C)n1-c1ccc(F)cc1 58928266 GUBFOJIOUNLVJJ-CIAFOILYSA-N 359.401 2.836 50 40 FFGB COC(=O)N1CCC(=NNC(=O)CCSc2ccc(F)cc2)CC1 83891334 DRNOGKSJAPGPAZ-UHFFFAOYSA-N 353.419 2.642 50 40 FFGB CN(C)c1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)o1 409001832 WXFHXAHMWYOSMM-RQZCQDPDSA-N 366.215 2.637 50 40 FFGB COc1ccc(C)c2sc(NNC(=O)[C@H]3COc4ccccc4O3)nc12 4121474 WVBJBLNEILDASS-CQSZACIVSA-N 371.418 2.896 50 40 FFGB N#C/C(=C\N1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccccc1 20572763 CVVGZCIBXAPZBP-LVZFUZTISA-N 367.474 2.643 50 40 FFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/NNC(=O)c1ccccc1 101150086 HPMFMTWILFQUHN-LFIBNONCSA-N 354.797 2.881 50 40 FFGB COc1ccc(Br)cc1C(=O)NNC(=O)c1cccs1 6646938 PLGJZRDWZNRPSH-UHFFFAOYSA-N 355.213 2.594 50 40 FFGB CCSc1nnc(S[C@@H](C)C(=O)NNC(=O)c2ccccc2)s1 7060907 MCDOALRTPIYUMW-VIFPVBQESA-N 368.509 2.592 50 40 FFGB CCOc1cccc(NC(=O)CCNC(=O)[C@@H](Br)CC)c1 8733198 XVWHZYAVHWCDLH-ZDUSSCGKSA-N 357.248 2.704 50 40 FFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@@H]1c1ccc(OCC)c(OC)c1 57509067 RCOIGSZCRMASQA-OAHLLOKOSA-N 368.817 2.504 50 40 FFGB Cc1cc2c(c(=O)n1C)[C@H](c1ccccc1Br)C(C#N)=C(N)O2 2325418 ZPALUBXCAKBUGE-CQSZACIVSA-N 372.222 2.674 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2cccc(F)c2)cc1 100571768 QIWLKCKLWTXFHR-LPYMAVHISA-N 357.385 2.898 50 40 FFGB CCc1ccc(-c2n[nH]cc2/C=N/NC(=O)c2cc(O)cc(O)c2)cc1 13321973 CLHREOPUCWPHAG-SRZZPIQSSA-N 350.378 2.814 50 40 FFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1ccc(C(=O)O)cc1 4735256 CIWNSJDNNRFIIL-VCHYOVAHSA-N 361.195 2.840 50 40 FFGB Cc1nn(-c2ccccc2)c(C)c1CCC(=O)NNC(=O)c1ccccc1 7898543 OLDYENIKRIEHTK-UHFFFAOYSA-N 362.433 2.883 50 40 FFGB COc1ccc(/C=N/NC(=O)Cn2c(C)nc3ccccc32)cc1OC 7993481 PMZXNHVZSFVGFQ-RGVLZGJSSA-N 352.394 2.512 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1 408678418 YVCNAVKFBDHFSI-KGENOOAVSA-N 351.406 2.837 50 40 FFGB COc1cc(Cl)c(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc1OC 408588128 HZFPXIIMNHQJQP-UFWORHAWSA-N 362.769 2.850 50 40 FFGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC 36145137 YYGHMLKZKHYMGS-BKUYFWCQSA-N 372.421 2.804 50 40 FFGB COc1cc(-c2cc(C(=O)NN)[nH]n2)ccc1OCc1ccc(C)cc1 40217063 REGIUPNAWNGWJC-UHFFFAOYSA-N 352.394 2.576 50 40 FFGB CC1=C(C)/C(=N/OS(=O)(=O)c2ccccc2)[C@@H](Cl)[C@@H](Cl)C1=O 105883095 OYWDQWATOQHBBL-FKQHZEHCSA-N 362.234 2.882 50 40 FFGB CC(=O)/C(C#N)=C1\NC(=O)[C@H](Cc2ccc(Br)cc2)S1 100983032 GZAPPVNNNJMCJQ-SEVUAYLXSA-N 351.225 2.547 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 1211807 VLRWCHUISUKXQQ-NEIHUHTASA-N 365.433 2.897 50 40 FFGB COc1cccc(NCC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1 12532936 SHSAGFPVZVMTNQ-GFCCVEGCSA-N 373.478 2.755 50 40 FFGB O=C(NCc1cccc(CNC(=O)C(Cl)Cl)c1)C(Cl)Cl 100977519 HNOPTDDWFAKGJN-UHFFFAOYSA-N 358.052 2.526 50 40 FFGB CN(NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 15133849 UXKNMZXCMVIFQP-UHFFFAOYSA-N 354.410 2.979 50 40 FFGB O=C(N/N=C\c1ccc(O)c(I)c1)c1cccs1 408962646 IVVQRNCPETUXET-AUWJEWJLSA-N 372.187 2.822 50 40 FFGB CC(C)Cc1ccc(CC(=O)NNC(=O)Cc2cn3ccsc3n2)cc1 8778444 VTWBOZAYEFJZHV-UHFFFAOYSA-N 370.478 2.527 50 40 FFGB C[C@@H](OCC(F)(F)F)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 42819281 QTNNQSHXUKLIJR-GYPVXTSCSA-N 362.392 2.708 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(F)cc2)c1C 408936368 HXNXQVMYNHKODB-KIHMUJGBSA-N 358.417 2.598 50 40 FFGB N#C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 778236 DOGVMBKYPXRYSI-FMIVXFBMSA-N 361.810 2.533 50 40 FFGB Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1/C=C(\C#N)c1ccccn1 6339589 KYJATHJTLCWBSR-RPHSKFLZSA-N 362.842 2.664 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1 1800458 ZFIVKKPZICWPPI-UHFFFAOYSA-N 356.422 2.525 50 40 FFGB CCCc1ccc(N2C[C@@H](C(=O)NNc3nc(C)cc(C)n3)CC2=O)cc1 12553714 ZHKGMMDSBUPWIY-INIZCTEOSA-N 367.453 2.542 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccccn2)ccc1OC(=O)c1ccco1 3212342 FNZRJNOSGXITAJ-CIAFOILYSA-N 365.345 2.666 50 40 FFGB COc1cc(/C=N/NC(=O)CC#N)ccc1OCc1ccc([N+](=O)[O-])cc1 4513368 NIVMGOKFBMSVIC-RGVLZGJSSA-N 368.349 2.546 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@H]12)N/N=C1/C[C@H]2C=CC[C@@H]12 17073336 GIRIUIXSQOYDQJ-PFJKHYMLSA-N 354.454 2.683 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3ccccc3Cl)CC2=O)cc1 96941881 DSNUUKPVZOWRQM-WHJAWBAWSA-N 371.824 2.852 50 40 FFGB COC(=O)[C@H](CNC(=O)[C@@H](C)Br)Cc1ccc(Cl)cc1 95097988 AVRVVAQZADXCHM-KOLCDFICSA-N 362.651 2.571 50 40 FFGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2O)c1C 3140246 VVHYDZNUSRXWSN-DJKKODMXSA-N 357.366 2.755 50 40 FFGB O=C(CSc1ccccn1)N/N=C/c1cc(Br)ccc1O 993703 COZYMVNZIWUBEK-CAOOACKPSA-N 366.240 2.792 50 40 FFGB Nc1nonc1C(=O)N/N=C/c1ccc(-c2cccc(C(F)(F)F)c2)o1 5944168 XYBYNYDRPDRHTR-IFRROFPPSA-N 365.271 2.695 50 40 FFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)c2ccc(C)cc2)c2ccccc21 20608613 WWSFYUIFRJWGME-QOCHGBHMSA-N 364.449 2.775 50 40 FFGB CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(C)n(CC)c(=O)c21 2325925 QZMHKIJXQNAKSY-QGZVFWFLSA-N 351.406 2.794 50 40 FFGB Cc1[nH]c2ccccc2c1/C=N\NC(=O)CNc1ccc2c(c1)OCO2 20033873 WJZKZBJPEOMXAJ-NKVSQWTQSA-N 350.378 2.767 50 40 FFGB NC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1cc2ccccc2oc1=O 5161778 YHUIOHAXDAUTAZ-SSDVNMTOSA-N 373.372 2.648 50 40 FFGB O=C(CNc1ccc2c(c1)OCO2)N/N=C\c1c(O)ccc2ccccc12 83329549 NJEXLAOEBYVVHN-YVNNLAQVSA-N 363.373 2.836 50 40 FFGB CCn1ncc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)c1C(F)(F)F 253400550 LJHJPKMBZUWVRK-GFCCVEGCSA-N 352.316 2.737 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2ccccc2I)o1 5618434 GMPQSDRIFIWMFS-OVCLIPMQSA-N 354.147 2.957 50 40 FFGB C/C(=N\NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O)C(C)(C)C 19955481 UBVHIFAMWJEWOG-NBVRZTHBSA-N 353.488 2.608 50 40 FFGB Cc1ccc(/C=C/S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1 55573500 UNXRMMAYELRNPL-VAWYXSNFSA-N 369.446 2.722 50 40 FFGB CCSc1ncc(Cl)c(C(=O)NNC(=O)c2ccc(C)cc2)n1 27995591 USONGSUOGRLFLF-UHFFFAOYSA-N 350.831 2.625 50 40 FFGB COC(=O)/C(C#N)=C/c1c(Oc2ccccc2)nc2c(C)cccn2c1=O 2427195 JBPKQWBPUHCZKQ-SDNWHVSQSA-N 361.357 2.875 50 40 FFGB CC1(C)[C@H](O)[C@]2(Br)CC[C@]1(CC(=O)O)[C@H]2Br 225516193 DRSFYJASRKYEEL-IFFSRLJSSA-N 356.054 2.539 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc(NC(C)=O)cc2)cc1 18045064 LQNZRLAGUNVKSW-LDADJPATSA-N 371.418 2.904 50 40 FFGB C[C@H](SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1)C(=O)N(C)c1ccccc1 12622474 SKLFTOMMQHVGHQ-JSGCOSHPSA-N 368.462 2.802 50 40 FFGB COc1cc(OC)cc([C@H]2C(C#N)=C(N)Oc3cc(N(C)C)ccc32)c1 13586135 FDLHTXDYCJEVSH-LJQANCHMSA-N 351.406 2.988 50 40 FFGB COc1cc(/C(C)=N\NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1O 5884990 UWMAZXZMIADQEZ-JAIQZWGSSA-N 374.393 2.581 50 40 FFGB O=C(NNc1ncnc2c1cnn2-c1cccc(Cl)c1)c1ccco1 7393236 FJQNATLNKMHOOA-UHFFFAOYSA-N 354.757 2.819 50 40 FFGB C[C@@H]1C=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3)[C@@]2(C)CN1C 19816147 MNEKLXLKKDRVIN-MJWYBRSISA-N 361.424 2.959 50 40 FFGB O=C(N/N=C\c1cc(Br)cs1)[C@H]1COc2ccccc2O1 13138657 LWWPCMSMTFJTED-LLYLVAKQSA-N 367.224 2.801 50 40 FFGB CN1CCN(C(=O)/C(C#N)=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 27025179 BORZNXRVZYXAQG-WYMLVPIESA-N 366.377 2.536 50 40 FFGB COc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)c(OC)c1 59444035 MCUDHFWICXQRPS-KEBDBYFISA-N 352.394 2.732 50 40 FFGB Cc1ccnc(Sc2oc(/C=C(\C#N)C(N)=O)cc2Br)n1 409275815 XEZCFXCVTJZYLR-XBXARRHUSA-N 365.212 2.684 50 40 FFGB CCOc1cc(/C=C(/C#N)C(=O)NC2CCCC2)ccc1OCC(=O)O 409189788 ITRUDECFCHRQLZ-ZROIWOOFSA-N 358.394 2.514 50 40 FFGB Cc1nn2c(/C=N/NC(=O)c3ccncc3)c(-c3ccccc3)nc2s1 41074125 GAWTYIYUWGVODV-RGVLZGJSSA-N 362.418 2.925 50 40 FFGB COC(=O)COc1cccc(/C=N/NC(=O)CCSc2ccccc2)c1 4502866 YIBVQOQJSVFNCM-DEDYPNTBSA-N 372.446 2.871 50 40 FFGB O=C(Cn1c(=O)oc2ccccc21)NNc1ccccc1C(F)(F)F 40160430 GBURWQSKILKUKZ-UHFFFAOYSA-N 351.284 2.757 50 40 FFGB CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C\c1ccc(OCC(N)=O)cc1 100233129 YDGWRCZBPYIVEK-CHHVJCJISA-N 371.400 2.559 50 40 FFGB COC(=O)c1ccc(N/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)cc1 102673254 GCZOTFCPMVPKRL-OWBHPGMISA-N 351.362 2.940 50 40 FFGB COC(=O)c1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1 806455 UBVCXYTVNQJOJJ-INIZCTEOSA-N 352.390 2.924 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1ccc([N+](=O)[O-])cc1 2462946 ZXLUSQUDUIRIPP-OAHLLOKOSA-N 360.329 2.654 50 40 FFGB CC1(C)[C@@]2(CBr)CC[C@]1(C(=O)O)[C@H](Br)C2=O 4137280 MFQZVXXGEBQQQI-DIMCTHFVSA-N 354.038 2.605 50 40 FFGB COc1ccc2cc(/C=N/NC(=O)CC3(C)OCCO3)c(Cl)nc2c1 1106409 YXLGCIANZQBOSF-VXLYETTFSA-N 363.801 2.500 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2)cc1OCC 59515626 UXLWJPIJPUILAW-KGENOOAVSA-N 369.421 2.963 50 40 FFGB NC(=O)Cn1cc(/C=N\NC(=O)c2cc3ccccc3o2)c2ccccc21 107741447 PMTVALFOWHYDRW-YVNNLAQVSA-N 360.373 2.637 50 40 FFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccccc3OC)[C@@H]2C1 4123650 ZFQVKRUKQQAEBZ-QUCCMNQESA-N 373.460 2.831 50 40 FFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc3c(c2)OCO3)cc1 5488911 JYFMLGYYGLOPEB-GDNBJRDFSA-N 358.375 2.675 50 40 FFGB Cc1nc(-c2c[nH]c(C(=O)NNc3nc(-c4ccncc4)no3)c2)cs1 102787795 XNIOUDLMEJAENS-UHFFFAOYSA-N 367.394 2.649 50 40 FFGB COc1ccc(CC(=O)NNC(=S)NCc2ccccc2)cc1Cl 27579265 RRRXXYVLKIOKSP-UHFFFAOYSA-N 363.870 2.587 50 40 FFGB O=C(NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1)C1CCCC1 84603590 BXZQPNHLKDEIIQ-AWEZNQCLSA-N 372.494 2.850 50 40 FFGB C=CCc1ccc(OCC(=O)N/N=C/c2ccc3c(c2)OCO3)c(OC)c1 993688 BLOLRAMMDRMYFT-SRZZPIQSSA-N 368.389 2.682 50 40 FFGB CCOc1ccc(N2C[C@@H](C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2=O)cc1 7929188 QIUBSOMCBMQKBV-ZDUSSCGKSA-N 370.361 2.952 50 40 FFGB COc1cccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)c1 106505458 NBTHESNLOBAALC-WSDLNYQXSA-N 359.385 2.959 50 40 FFGB CSc1ncccc1C(=O)NNC(=O)c1ccccc1-n1cccc1 6549718 ZTHOGHNGSKBXLX-UHFFFAOYSA-N 352.419 2.669 50 40 FFGB CCN(CC)C(=O)C(=O)N/N=C/c1cc(C)n(-c2ccccc2C)c1C 408970791 KJOLFAJGHDVEJY-FYJGNVAPSA-N 354.454 2.721 50 40 FFGB O=C(N/N=C/c1cccc(OCc2ccc(Cl)cc2)c1)C(=O)NC1CC1 408609916 MABOZOXZUCCCJC-SRZZPIQSSA-N 371.824 2.648 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3sccc3C)CC2=O)cc1 409268571 VZMBQSUXLBRHEK-GJUHEBOISA-N 357.435 2.568 50 40 FFGB COC(=O)c1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1 806456 UBVCXYTVNQJOJJ-MRXNPFEDSA-N 352.390 2.924 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 6439781 QIYQPPJZKBKXHV-UHFFFAOYSA-N 363.757 2.722 50 40 FFGB CCS(=O)(=O)[C@H](I)[C@H](O)c1ccc(Cl)cc1 96519252 ZHTHAKSDTTVRCG-ZJUUUORDSA-N 374.627 2.569 50 40 FFGB COc1cccc2sc(NNC(=O)[C@@H]3COc4ccccc4O3)nc12 4121325 WMLRMPWNFMVGNE-ZDUSSCGKSA-N 357.391 2.588 50 40 FFGB COc1ccc(-c2[nH]ncc2/C=N/NC(=O)c2cccs2)cc1OC 8567888 AVWAVNCLOCIKMV-VXLYETTFSA-N 356.407 2.919 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCC1)c1cccc(Cl)c1 408769699 ZPNMAWKCOZZDSO-UHFFFAOYSA-N 357.863 2.542 50 40 FFGB Cc1ccc(C2=CS/C(=C(\C#N)C(=O)CSc3nnc[nH]3)N2)cc1 103430147 HHTDIYHJRRMVCW-NTCAYCPXSA-N 355.448 2.845 50 40 FFGB CC[C@H](C)NC(=O)C/C(C)=N/NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 4402172 JZICTIRQIQRTQI-QDUVGAFFSA-N 354.794 2.659 50 40 FFGB N#CC(C#N)=C(NC1CC1)S[C@H]1CC(=O)N(c2cccc(Cl)c2)C1=O 215696696 AILJBUSPJMKIIU-AWEZNQCLSA-N 372.837 2.716 50 40 FFGB Cc1ccc(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)cc1 101195234 GIADFOWGSIJLCB-OKDXSUHISA-N 350.212 2.505 50 40 FFGB CC1(C)[C@@H](C(=O)NNC(=O)c2ccccc2Cl)CC[C@]1(C)C(=O)O 3140913 YEASDIDAPOSPIL-PIGZYNQJSA-N 352.818 2.628 50 40 FFGB N#CC1=C(S)NC(c2cccnc2)=C(C(N)=S)[C@H]1c1ccncc1 2361677 UDPZGQPMDCRYTO-ZDUSSCGKSA-N 351.460 2.526 50 40 FFGB O=C(N/N=C1\CCSc2ccc(F)cc21)[C@@H]1COc2ccccc2O1 5164166 TWXRPCRUEICZNH-UOEVCUDDSA-N 358.394 2.982 50 40 FFGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cccc([N+](=O)[O-])c1 408884734 ZEUSFJCFJAYJTP-VGOFMYFVSA-N 353.334 2.575 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(Cl)cc1 408605162 KSSDIAORFNIYLJ-ZDUSSCGKSA-N 360.826 2.898 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)ccc1OC 6155473 JPCYBBIQCLAVLW-UDWIEESQSA-N 358.394 2.875 50 40 FFGB CCCc1[nH]nc2c1C1(CCN(C(=O)OC(C)(C)C)CC1)C(C#N)=C(N)O2 809376 YKDLJUYDLGUKMQ-UHFFFAOYSA-N 373.457 2.717 50 40 FFGB CN(NC(=O)c1cccc2ccccc12)C1=NS(=O)(=O)c2ccccc21 59488038 ADFRLELREUHRON-UHFFFAOYSA-N 365.414 2.566 50 40 FFGB COc1cc(/C=N\NC(=O)c2ccc(C)o2)cc(Br)c1O 110062814 XUACPFBTUMHHLN-APSNUPSMSA-N 353.172 2.829 50 40 FFGB O=C(Cc1cn2ccsc2n1)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl 9337157 MDRJMFGIQHUJAE-CHWSQXEVSA-N 374.853 2.543 50 40 FFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2Cl)cc1 32138862 FCPHFMWONOFELB-SRZZPIQSSA-N 359.813 2.505 50 40 FFGB COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2cccc([N+](=O)[O-])c2)c1 408875660 GTEPNAGZCLWFSZ-RIYZIHGNSA-N 353.334 2.575 50 40 FFGB N#CC1=C(N)Oc2[nH]c(=S)[nH]c(=O)c2[C@@H]1c1c(Cl)cccc1Cl 5530637 YUCSMZFTRNURKS-QMMMGPOBSA-N 367.217 2.957 50 40 FFGB COc1cc(/C=N/NC(=O)c2cc(Cl)ccc2O)cc(OC)c1O 695454 PVAASNWLCHAWBQ-QGMBQPNBSA-N 350.758 2.532 50 40 FFGB Cc1cccc(C)c1-n1c(C)cc(/C=N/NC(=O)C(=O)NC(C)C)c1C 58903881 HNVOHFRIMMTVFI-SRZZPIQSSA-N 354.454 2.686 50 40 FFGB Cc1ccccc1OCC(=O)N[C@H](C(=O)N/N=C/c1cccs1)C(C)C 4680627 HDJREQUIMPNYAD-PQFHHTBUSA-N 373.478 2.726 50 40 FFGB Cc1c(C)c(C)c(S(=O)(=O)NNC(=O)c2ccccc2F)c(C)c1C 7428900 BKVXOEWTGBZNFU-UHFFFAOYSA-N 364.442 2.991 50 40 FFGB COC(=O)c1ccc(/C=N\NC(=O)CCn2c(C)nc3ccccc32)cc1 33147701 CSZMGUZVXTUOKS-BKUYFWCQSA-N 364.405 2.672 50 40 FFGB O=C(NCc1ccc(Cl)cc1)C(=O)N/N=C\c1c(F)cccc1Cl 83316882 BORZHYZHDGWGBC-NKVSQWTQSA-N 368.195 2.899 50 40 FFGB C/C(CC(=O)NNc1ccc([N+](=O)[O-])cc1)=N/Nc1ccc([N+](=O)[O-])cc1 5159046 KHKMDZKMUZEDKN-BOPFTXTBSA-N 372.341 2.824 50 40 FFGB CCn1ncc(N(C)NC(=O)Nc2ccc(Cl)cc2)c(Cl)c1=O 3104670 HHWXMMDDUGVUHH-UHFFFAOYSA-N 356.213 2.743 50 40 FFGB COc1cc(C(=O)NNC(=O)CSc2ccc(C)cc2)cc(OC)c1C 6507660 TWTZMNLHAXTCEC-UHFFFAOYSA-N 374.462 2.874 50 40 FFGB O=C(CCl)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 8264109 NMKMSYQBPDKDDV-UHFFFAOYSA-N 351.255 2.692 50 40 FFGB C[C@@H]1CCc2sc(C(=O)NNC(=O)c3ccc4c(c3)COC4)cc2C1 64485824 NJXKQHCCTBNLBQ-LLVKDONJSA-N 356.447 2.978 50 40 FFGB CC(C)=NO[C@]1(c2ccc(Cl)cc2)OC(N)=C(C#N)C1=C(C#N)C#N 100257450 SQOXMGCKHSBZRF-KRWDZBQOSA-N 353.769 2.973 50 40 FFGB COc1cc(C(=O)N/N=C/c2ccccc2C(=O)O)ccc1OC(C)C 13356845 OVBADHXZECCWOH-RGVLZGJSSA-N 356.378 2.945 50 40 FFGB NC(=O)c1cc2cc(Cl)ccc2o/c1=N\NC(=O)c1cccc(F)c1 652699 LTGHIPYRVYIBLX-XLNRJJMWSA-N 359.744 2.570 50 40 FFGB CC(=O)Nc1ccc(C(=O)NNC(=O)c2ccccc2-n2cccc2)cc1 15269024 GYAROFOFXAMRIZ-UHFFFAOYSA-N 362.389 2.511 50 40 FFGB Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)C2 8336799 QAYUIUMBANTOKY-AWQFTUOYSA-N 352.394 2.678 50 40 FFGB Cc1cccc(C(=O)NNC(=O)CCC(=O)Nc2ccc(C)cc2C)c1 2132087 VPHPOFFHAJLOMK-UHFFFAOYSA-N 353.422 2.792 50 40 FFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc(C)s3)CC2=O)cc1 2221039 FOELUROXHAKMOI-HXJASHHUSA-N 371.462 2.958 50 40 FFGB CC(C)c1n[nH]c(S[C@@H](C)C(=O)NNC(=O)c2cccc(Cl)c2)n1 9336044 YWGJGHFLBWXYFZ-VIFPVBQESA-N 367.862 2.523 50 40 FFGB COc1ccc(CNC(=O)c2c(C)nn(CCCl)c2C)cc1OC 72283971 FMOGVAJPPUJTDR-UHFFFAOYSA-N 351.834 2.686 50 40 FFGB O=C(CCCCCSSc1ccccn1)ON1C(=O)CCC1=O 146780535 GUNOUNRTBRPXOQ-UHFFFAOYSA-N 354.453 2.990 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C/c1ccc(OC)c(OC)c1 3140305 GXTRCRHZMUTPLH-UDWIEESQSA-N 358.394 2.632 50 40 FFGB Cc1ccc(S(=O)(=O)NC(=O)NNc2nc3ccccc3s2)cc1 2296417 SQXBWWAOSAXZMY-UHFFFAOYSA-N 362.436 2.620 50 40 FFGB O=C(Cc1ccc(Cl)cc1)NN[C@@H](C(=O)NC1CC1)c1ccccc1 12763971 DDIFUHNPFLFTEK-GOSISDBHSA-N 357.841 2.523 50 40 FFGB CC1(C)CC(=O)C2=C(C1)NC(SCC(N)=O)=C(C#N)[C@@H]2c1ccco1 12250528 PRFCYAYGORCCPG-OAHLLOKOSA-N 357.435 2.563 50 40 FFGB Cc1ccc(C)c(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCC3)c2C)c1 4091327 MVTLGBUWTBAOCP-LPYMAVHISA-N 366.465 2.783 50 40 FFGB C/C(=N\NC(=O)COc1cccc(Br)c1)c1cccc(N)c1 6368057 JMJPORGMXXFVCT-YBFXNURJSA-N 362.227 2.951 50 40 FFGB N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)NC(N)=O 409221823 VHVLXSNEDZDHJB-YVMONPNESA-N 360.713 2.610 50 40 FFGB CCO[C@@H](C)n1nccc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402640 OMWSKAYNKKXXGQ-MEDUHNTESA-N 356.426 2.889 50 40 FFGB Cc1cc(C(=O)N/N=C/c2ccc(OC(=O)c3cccs3)cc2)[nH]n1 18107761 ALFQJNFYJZYEQU-VCHYOVAHSA-N 354.391 2.763 50 40 FFGB COc1ccc(NS(=O)(=O)c2ccc(NC(=O)CCl)cc2)cc1 2754763 FHUOQQXHOHCOLK-UHFFFAOYSA-N 354.815 2.673 50 40 FFGB C/C=C/C=C/C(=O)NNC(=O)c1cc(OCC)c(OCC)c(OCC)c1 12943413 NURVAWSCCLWSNQ-NJNCEADSSA-N 362.426 2.776 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2ncccc2C(F)(F)F)cc1 92210172 IONIBBSOEFRAPD-UHFFFAOYSA-N 353.300 2.574 50 40 FFGB Cc1cc(C)cc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCC3)c2C)c1 408971360 IVQCEHOOIWIWPQ-LPYMAVHISA-N 366.465 2.783 50 40 FFGB Cc1nc2ccc(Br)cn2c1C(=O)N/N=C/c1ccccn1 409019955 LCDMUBJTPJVULA-QGMBQPNBSA-N 358.199 2.564 50 40 FFGB Cc1ccc(C(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O)o1 409038209 ZVWKDRWPHMWXGO-GIDUJCDVSA-N 368.143 2.728 50 40 FFGB CC[C@@H](C(=O)N/N=C/c1ccc(F)s1)n1cc(Br)cn1 252487463 HWLHXCCLWFHCEG-JFEKIERCSA-N 359.224 2.948 50 40 FFGB C[S@@](=O)Cc1cccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1 21324019 NXKJCYPKLZYXLR-KLQXSTNGSA-N 374.506 2.543 50 40 FFGB O=C(NN1C(=O)[C@@H](Cl)[C@H]1c1ccccc1Cl)c1ccccc1O 1633514 ZOODFJBHTYHNCK-UONOGXRCSA-N 351.189 2.881 50 40 FFGB Cc1ccccc1OCC(=O)NNC(=O)CCSc1ccc(F)cc1 12680530 BLQAALOLGDOBJO-UHFFFAOYSA-N 362.426 2.843 50 40 FFGB CN(C)c1ccc(/C=N/NC(=O)c2ccccc2N)cc1Br 409031682 HZPYAQAMXQMXLT-VXLYETTFSA-N 361.243 2.861 50 40 FFGB C/C(=N\NC(=O)CCC(=O)NCc1ccccc1)c1cccc([N+](=O)[O-])c1 4523912 ZHHZABMQXQWRAF-KGENOOAVSA-N 368.393 2.532 50 40 FFGB COc1cccc(/C=N/NC(=O)CN2Cc3cc(C)c(C)cc3C2)c1OC 409206996 YDCMGFOQLAKCAL-LSHDLFTRSA-N 367.449 2.787 50 40 FFGB O=C(CN1C[C@@H](c2ccccc2)CC1=O)N/N=C/c1ccccc1Cl 408973989 SVCXRHCPOPPRQH-XYHOIZSOSA-N 355.825 2.806 50 40 FFGB Cc1nc(CSCCC(=O)NNC(=O)c2ccccc2F)cs1 40069556 BWTVBAUIWZLMCW-UHFFFAOYSA-N 353.444 2.675 50 40 FFGB C/C(CCc1ccccc1)=N\NC(=O)CN(c1ccccc1)S(C)(=O)=O 19954106 PCUYYYQGPKQJBD-CAPFRKAQSA-N 373.478 2.578 50 40 FFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2ccc(O)c(OC)c2)cc1 32565552 BKHIUKLRYZHYOU-NHDPSOOVSA-N 366.377 2.563 50 40 FFGB Cc1c(C)[n+](=O)c2c(n1O)[C@H](Br)CC[C@H]2Br 104096691 PLANLDNZPQGAQC-HTQZYQBOSA-N 353.034 2.923 50 40 FFGB C/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1ccccn1 18115961 NZZFVYIPGZXGCF-SREVYHEPSA-N 373.228 2.622 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2cc3ccccc3c(OC)n2)cc1 48303549 DLJZRZSVDWDDDX-UHFFFAOYSA-N 365.389 2.717 50 40 FFGB C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(F)c3)cc2C1 7403166 IHRLCBSWIYQLAC-SNVBAGLBSA-N 368.455 2.635 50 40 FFGB Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1ccccc1O 17526709 UFJXDKRSGSGMCC-UHFFFAOYSA-N 362.813 2.974 50 40 FFGB Cc1ccc(Cc2c(N)nn3c2N[C@@H](c2cccnc2)C(C#N)=C3N)cc1 8707056 JZQVAUJLXYAWLN-KRWDZBQOSA-N 357.421 2.577 50 40 FFGB CSCc1ccc(C(=O)NNC(=O)CNc2c(C)cc(C)cc2C)o1 8720934 ABFGEKXOIOZSLE-UHFFFAOYSA-N 361.467 2.941 50 40 FFGB C/C(=N\NC(=O)CNc1ccc(C)cc1C)c1ccc2c(c1)CC(=O)N2 98054886 IIAOPWYCAJPGPT-OEAKJJBVSA-N 350.422 2.750 50 40 FFGB Cc1cc(/C=N\NC(=O)c2ccncc2)c(C)n1-c1ccc(C(=O)O)cc1 408843803 UFWLLYHAYGCHOM-UUYOSTAYSA-N 362.389 2.951 50 40 FFGB O=C(NNC(=O)C1CC1)c1cn(Cc2ccccc2)nc1-c1ccccc1 32674331 UBTYIVUMWVWIHN-UHFFFAOYSA-N 360.417 2.769 50 40 FFGB CCOC(=O)C(CCC[Si](OCC)(OCC)OCC)C(=O)OCC 195767651 RKNYOHXRCRXQOS-UHFFFAOYSA-N 364.511 2.557 50 40 FFGB O=C1O[C@@H]2[C@H](Br)[C@H]3C[C@@H]2[C@H]1[C@H]3C(=O)Nc1ccccc1Cl 4727481 IHRKASQQGMYREB-LGHQWOBVSA-N 370.630 2.850 50 40 FFGB Cc1ccc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1C 102612196 SSEYSTVHQULNHX-YRKSKIDTSA-N 364.239 2.813 50 40 FFGB CC1=C(C(=O)c2ccccc2)[C@@]2(C(=O)Nc3ccccc32)C(C#N)=C(N)O1 1054622 QIVBTMVLJLAQHK-NRFANRHFSA-N 357.369 2.757 50 40 FFGB Cc1cc(/C=C(\C#N)c2nc(N)nc(N(C)C)n2)c(C)n1Cc1ccco1 14022676 JEIIQWGDNCSRGO-OQLLNIDSSA-N 363.425 2.644 50 40 FFGB O=C(N/N=C/c1c(F)c(F)c(F)c(F)c1F)[C@H]1COc2ccccc2O1 6684326 FBUCLDXYHYKCBL-BDQPDOFKSA-N 372.249 2.672 50 40 FFGB Cn1c(CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)nc2ccccc21 6651810 OYGWIMDLUACHFR-UHFFFAOYSA-N 364.449 2.875 50 40 FFGB C/C(=N\NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1)c1ccc(C)cc1 409137533 VSOICHYLTGRKDZ-XMHGGMMESA-N 359.451 2.545 50 40 FFGB C[C@H](NC(=O)/C(C#N)=C/c1ccc(N2CCOCC2)o1)c1ccccc1 1096162 AVPXLQLWDWTIRN-XOAFGZPJSA-N 351.406 2.901 50 40 FFGB O=C(S[C@@H]1CS(=O)(=O)C[C@H]1Cl)c1ccccc1Br 16789895 VYPSIHSPXGUPES-NXEZZACHSA-N 369.689 2.727 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(Br)o2)c(OC)c1 6170224 GQQVRUABOIUZBL-LZYBPNLTSA-N 353.172 2.823 50 40 FFGB O=C(N/N=C/c1c(F)cccc1Cl)[C@H]1CC(=O)N(c2ccccc2)C1 656797 GPONVGJEPJYEDD-SQWLXVSWSA-N 359.788 2.982 50 40 FFGB O=S(=O)(c1c(F)c(F)c(F)c(F)c1F)N(CCCl)CCCl 1592697 SDYZJLQOHSGUCF-UHFFFAOYSA-N 372.142 2.850 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1OC 6647022 GDIQJQTWHHDUGA-ZSOIEALJSA-N 352.346 2.948 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c2C)cc1 59959623 HOVJWXDLHDUYCS-WSDLNYQXSA-N 354.454 2.625 50 40 FFGB COC(=O)[C@]12CC[C@@](CBr)(C(=O)[C@@H]1Br)C2(C)C 109275167 PVYFESIMHVMBHV-BPTDKIDVSA-N 368.065 2.693 50 40 FFGB O=C(Cc1cccc2ccccc12)NNC(=O)CC1(C(=O)O)CCCC1 10828583 FJFMIUDVMWKADM-UHFFFAOYSA-N 354.406 2.565 50 40 FFGB Cc1cc2c(c(=O)n1C)[C@@H](c1ccccc1Br)C(C#N)=C(N)O2 2325416 ZPALUBXCAKBUGE-AWEZNQCLSA-N 372.222 2.674 50 40 FFGB O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1c[nH]nc1-c1ccccc1 29050710 INAAKPVKUDNVIR-UHFFFAOYSA-N 359.389 2.562 50 40 FFGB Cc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)s1 12805010 NKARNAPHGGFFDW-SECBINFHSA-N 370.521 2.866 50 40 FFGB Cc1cc(C(=O)NN[C@@H](C(=O)N2CCCCC2)c2ccccc2)c(C)o1 15472883 YGPNFSDMDFYLHU-GOSISDBHSA-N 355.438 2.885 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C(\C)c2ccc(OC)c([N+](=O)[O-])c2)c1 408710576 KQWFQMUOZYVGLS-YBFXNURJSA-N 373.365 2.775 50 40 FFGB COCc1n[nH]c2c1[C@H](c1ccccc1C(F)(F)F)C(C#N)=C(N)O2 809408 ZGSRJNRWLBRQLK-GFCCVEGCSA-N 350.300 2.793 50 40 FFGB CNC1=C/C(=N\C2=C/C(=N/C(=C\C#N)C(C)(C)O)OC2(C)C)OC1(C)C 104311076 UEVOZOYNOPOHNZ-WDKFEMEUSA-N 358.442 2.567 50 40 FFGB Cc1nc2ccc(Br)cn2c1C(=O)N/N=C/c1ccc(O)cc1 58885529 OWCOVKWLVJPJMZ-QGMBQPNBSA-N 373.210 2.875 50 40 FFGB Cc1ccccc1SCC(=O)NNC(=O)CN1CCCc2ccccc21 6509174 ZDOFYVPNMWIQOY-UHFFFAOYSA-N 369.490 2.687 50 40 FFGB Cc1ccc(/C=N/NC(=O)C(=O)N/N=C/c2ccc(C)cc2C)c(C)c1 5538396 ZDHLPBMEYZTJKW-XHQRYOPUSA-N 350.422 2.521 50 40 FFGB COc1ccc(C(=O)N/N=C\c2cc(Cl)c(O)c(OC)c2)cc1OC 409317647 QXDOOBOKABBPLQ-OCKHKDLRSA-N 364.785 2.835 50 40 FFGB CCOC(=O)COc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(O)cc1 408788112 IKOVPFOTMGVSFK-RVDMUPIBSA-N 366.373 2.880 50 40 FFGB CCCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccco2)s1 408730562 IBFHZAUCZDEPLA-GZTJUZNOSA-N 363.443 2.733 50 40 FFGB CC(C)c1ccc(/C=N/NC(=O)Cn2nnc(-c3ccc(F)cc3)n2)cc1 5205857 ZESMOJWWBUZJHB-SRZZPIQSSA-N 366.400 2.753 50 40 FFGB O=C(CSc1nc2ccccc2[nH]1)NNC(=O)c1ccc(Cl)cc1 13284263 MCEWQYDUFFPOQC-UHFFFAOYSA-N 360.826 2.770 50 40 FFGB C/C(=N\NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1F 7983230 ADDNYYCJRQTHPQ-HAVVHWLPSA-N 368.456 2.878 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3c(OC)c(OC)ccc3[nH]2)cc1 2359611 BCEGMSJXUOKGLG-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB O=C(NNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(Cl)cc1 2632031 WVKYRHFILYFQKX-KRWDZBQOSA-N 374.824 2.973 50 40 FFGB CC1=C(C)C[C@@H](C(=O)NNC(=O)c2cccc(Cl)c2)[C@@H](C(=O)O)C1 5044980 YESXGRJZKOEVKU-KGLIPLIRSA-N 350.802 2.548 50 40 FFGB CCOC(=O)[C@H](C)/C(C)=N/NC(=O)CCC(=O)Nc1cc(C)ccc1C 4523953 MQIGXIUEQKDHKG-YRHWPSCSSA-N 361.442 2.713 50 40 FFGB CCOc1ccccc1C(=O)NNC(=O)c1ccc2c(c1)nc(C)n2CC 6609112 LPXMIKXIKBDFOU-UHFFFAOYSA-N 366.421 2.838 50 40 FFGB Cc1cc(C(=O)N/N=C/c2cc(Cl)cc(Br)c2O)[nH]n1 8969081 YFLJZSONFOUXGT-PJQLUOCWSA-N 357.595 2.604 50 40 FFGB O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(Br)cc1 9805709 VMCRTECBCYVHBQ-UHFFFAOYSA-N 372.222 2.865 50 40 FFGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)c1cccc(-n2cccc2)c1 408963051 LXIXIRMCPOSMHW-UNOMPAQXSA-N 350.334 2.855 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@H]1c1ccc(C(=O)O)cc1 20086641 FEJWHEGDYWFSNW-HNNXBMFYSA-N 372.336 2.526 50 40 FFGB COc1cc(-c2cc(C(=O)NN)c3ccccc3n2)cc(OC)c1OC 3191611 NTQDNSKICKJABG-UHFFFAOYSA-N 353.378 2.531 50 40 FFGB C[C@@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/C1=Cc2ccccc2O[C@@H]1C 2437851 MVRQREBAXNWAMR-JUBRQWKQSA-N 359.426 2.866 50 40 FFGB Cc1cc(/C=N/NC(=O)CN2CCOCC2)c(C)n1-c1ccccc1Cl 28216605 OSASHGKIIFOSJS-CIAFOILYSA-N 374.872 2.530 50 40 FFGB Cc1ccccc1NC(=S)NNC(=O)c1ccc2c(c1)NC(=O)CS2 6510110 ZZUMCCCCJVQEBN-UHFFFAOYSA-N 372.475 2.671 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 5527604 WAXBJTIZJQZBEJ-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB C/C(=N\NC(=O)CNC(=O)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 15133696 QVBBYQWENAYIBH-RGVLZGJSSA-N 374.784 2.518 50 40 FFGB O=C(O)c1ccccc1C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 668292 GQHYFFHAKWRLRB-UHFFFAOYSA-N 374.396 2.978 50 40 FFGB Cc1cc([N+](=O)[O-])nn1CC(=O)N/N=C/c1cccc(Cl)c1Cl 2269348 GOCDUZFQXSPCCR-OMCISZLKSA-N 356.169 2.557 50 40 FFGB O=C(N/N=C/c1cc2cc3c(cc2nc1Cl)OCCO3)c1ccncc1 2390179 QXDHPFIQRPSOST-UFFVCSGVSA-N 368.780 2.818 50 40 FFGB CN(C)c1nc(N)nc(/C(C#N)=C/c2csc(-c3ccc(F)cc3)n2)n1 11298393 SSSKOYWSZUZOIJ-YRNVUSSQSA-N 367.413 2.847 50 40 FFGB CCCc1cc(=O)[nH]c(SCC(=O)C(C#N)=C2Nc3ccccc3N2)n1 13930252 FFOKNEWFEHODSK-UHFFFAOYSA-N 367.434 2.656 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(C)cc1 15893530 HRQZIOMBJAXCDI-GFCCVEGCSA-N 362.813 2.886 50 40 FFGB O=C(N/N=C/c1ccccc1F)C(=O)Nc1cccc(C(F)(F)F)c1 3059241 ZFELNMARRPLVAJ-ZVBGSRNCSA-N 353.275 2.933 50 40 FFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2Cl)cc1 6430312 MJCINXZOVIHADB-WSDLNYQXSA-N 373.840 2.895 50 40 FFGB C[C@H]1CCCN([C@@H](C)CNS(=O)(=O)c2ccc(CCCl)cc2)C1 55591536 VZJLUSYXSDJNMO-GJZGRUSLSA-N 358.935 2.867 50 40 FFGB CCOC(=O)c1c(C)[nH]c(C(=O)N/N=C/c2ccc(OC)c(OC)c2)c1C 2686076 GJZFCLGIUBQRDQ-KEBDBYFISA-N 373.409 2.589 50 40 FFGB CCc1cc(C)cc(OCC(=O)N/N=C\c2ccc(O)c([N+](=O)[O-])c2)c1 408904255 HCXJWZPMUAULDM-GRSHGNNSSA-N 357.366 2.700 50 40 FFGB NNC(=O)c1ccc([C@@H]2c3sc(=O)[nH]c3S[C@H]3[C@H]4CC[C@@H](C4)[C@@H]32)cc1 245241597 KJTWZWQRLVXAGM-YHQUGGNUSA-N 373.503 2.692 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])s1)c1cc(Br)ccc1O 5206158 LZTHEFWNJBNGRW-MKMNVTDBSA-N 370.184 2.888 50 40 FFGB N=C(NNC(=O)c1cccc(F)c1)c1cc2cc(Cl)ccc2oc1=O 3198221 SMBJULNHZSCLLF-UHFFFAOYSA-N 359.744 2.845 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(N(C)C)cc2)cc1 4697881 PBTYXQXYUZMYMB-HYARGMPZSA-N 368.437 2.896 50 40 FFGB CCC[C@H](C(=O)OCC)/C(C)=N\NC(=O)Cc1ccc(OC)c(OC)c1 4776291 OACSLLZNVGIOJH-HYTQYMIGSA-N 364.442 2.718 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 6962044 HCZXEEBCSMQGMJ-HJGVYBFFSA-N 369.396 2.728 50 40 FFGB CCOC(=O)NNC(=O)c1cc(-c2cccs2)nc2c1cnn2CC 36656031 SGWCVMRRJRQJHM-UHFFFAOYSA-N 359.411 2.571 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cc1OC 6293797 CJIFIIPHCVEZKJ-FYJGNVAPSA-N 367.405 2.982 50 40 FFGB O=C(CCc1ccccc1)N/N=C/c1cc([N+](=O)[O-])c2cccnc2c1O 59459119 XYJMNGIKTZVIFD-CIAFOILYSA-N 364.361 2.932 50 40 FFGB CCOC(=O)CP(=O)(OOCC(F)(F)F)OOCC(F)(F)F 97972458 CWLFJNBVPDTCLT-UHFFFAOYSA-N 364.131 2.764 50 40 FFGB CC(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2F)c(Cl)c1 409375149 GGWPQYAFUWRLHF-AWQFTUOYSA-N 363.776 2.967 50 40 FFGB O=C(CCc1ccc(-c2ccccc2)o1)NNC(=O)c1cc([N+](=O)[O-])c[nH]1 12688424 INGYMGVTUUCTHP-UHFFFAOYSA-N 368.349 2.577 50 40 FFGB Cc1[nH]nc(-c2ccc(OCC(=O)NN)cc2O)c1-c1ccc(Cl)cc1 8973405 FVDPNNHRJQXXCM-UHFFFAOYSA-N 372.812 2.780 50 40 FFGB Cc1ccc(-c2noc(SCC(=O)NNC(=O)c3ccccc3)n2)cc1 7604857 DHIBDRWDYANSOK-UHFFFAOYSA-N 368.418 2.598 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2ccc(OC)c(OC)c2)c(OC)c1 4590476 FMWDWLRZRKEQDK-UDWIEESQSA-N 358.394 2.875 50 40 FFGB COC(=O)c1ccc(N/C=C(\C#N)C(=O)NCc2ccc(OC)cc2)cc1 6719375 BRNXYQZUIJBEOG-DTQAZKPQSA-N 365.389 2.618 50 40 FFGB COc1ccc(OC)c(COc2ccc(/C=C(\C#N)C(N)=O)cc2OC)c1 408989084 JTQMQLUAMPVOCE-RIYZIHGNSA-N 368.389 2.684 50 40 FFGB CC[C@@H](Nc1ccccc1)C(=O)N/N=C/c1cc(OC)cc([N+](=O)[O-])c1O 36047257 NAGVLXCUWTZXHB-SKCQWOFPSA-N 372.381 2.650 50 40 FFGB O=C(N/N=C/c1ccsc1)c1ccc(C(=O)N/N=C/c2ccsc2)o1 6334421 MTYXZRMOISSNCG-ZEELXFFVSA-N 372.431 2.930 50 40 FFGB Cc1c(C(=O)N/N=c2/sc3ccccc3n2C)[nH]c2c1C(=O)CCC2 30680237 APIFIOZIQSUDCI-DYTRJAOYSA-N 354.435 2.641 50 40 FFGB C[C@H](Br)C(=O)NC[C@@H](O[C@H]1CCOC1)c1cccc(F)c1 109912918 VHPHYPYBRHIIEX-LEWSCRJBSA-N 360.223 2.572 50 40 FFGB Cn1cc(C(=O)NNC(=O)N2CCc3sccc3C2)c2ccccc21 10260236 URPWLRPTNLJKBL-UHFFFAOYSA-N 354.435 2.653 50 40 FFGB O=C(N/N=C/c1cc(Cl)ccc1Nc1ccccc1F)C(=O)NC1CC1 408708068 NUBVSXIDPBJNGG-UFFVCSGVSA-N 374.803 2.951 50 40 FFGB C[C@@H](Sc1ncccn1)C(=O)N/N=C/c1cccc(Br)c1 1436848 NTSAZFQVFUPEDH-SVXRXWARSA-N 365.256 2.870 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3c(OC)ccc(OC)c3[nH]2)cc1O 2212879 HHQDIIXGJMMKLS-KEBDBYFISA-N 369.377 2.663 50 40 FFGB COc1cc(OC)c(/C=N/NC(=O)CNC2CCCCC2)cc1Cl 409381842 KAKSEPWSCREMHB-KEBDBYFISA-N 353.850 2.730 50 40 FFGB Cc1ccc(/C=N/NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1 408773827 SWPRNJXVHOKYGL-UDWIEESQSA-N 373.478 2.528 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1OC 408586968 DIDDSHGKBKNUTI-UDWIEESQSA-N 356.378 2.515 50 40 FFGB CCOc1cc(/C=N/NC(=O)[C@H]2[C@@H]3CCCC[C@@]32C)cc([N+](=O)[O-])c1O 17074389 CAZHQBFCYZCVHJ-GXGCMBLYSA-N 361.398 2.976 50 40 FFGB Cc1ccc(-c2nnc(SCC(=O)NN)n2-c2ccc(Cl)cc2)cc1 36724722 FNPRUIRAHOUPQG-UHFFFAOYSA-N 373.869 2.978 50 40 FFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)cc(OC)c1O 5051893 UIWDMJYFIMEZFS-CYBMUJFWSA-N 370.409 2.648 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)cc1 408790211 VDLPZIRABJVUAM-RIYZIHGNSA-N 350.330 2.748 50 40 FFGB COc1ccc(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 33907687 MZUIIYVTSBQIIK-YQODDJSKSA-N 351.406 2.507 50 40 FFGB CCc1sc(C(=O)NNC(=O)CC2(C(=O)O)CCCCC2)cc1C 10023370 XSEIIEUWYVNMLJ-UHFFFAOYSA-N 352.456 2.805 50 40 FFGB CCOc1ccccc1OCCCC(=O)NNC(=O)c1ccc(F)cc1 5558076 WXASHLSHUFRIDI-UHFFFAOYSA-N 360.385 2.845 50 40 FFGB O=C(COc1ccc(Cl)cc1)N/N=c1/c(=O)c2cccc3cccc1c32 6640976 VATUOWPDSRMERA-FCDQGJHFSA-N 364.788 2.893 50 40 FFGB CCOc1ccc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC 4740782 YYGHMLKZKHYMGS-FYJGNVAPSA-N 372.421 2.804 50 40 FFGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(N2CCOCC2)o1 409001212 VMHXQSFKNRLODC-NPRIEWAGSA-N 373.478 2.888 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 16136999 YEKXBCPZECDGIP-WOJGMQOQSA-N 372.337 2.595 50 40 FFGB COc1ccccc1NC(=O)/C(C#N)=C/c1cc(OC)c(O)c(OC)c1 3570577 QXYXAIYVOHEWHO-MDWZMJQESA-N 354.362 2.964 50 40 FFGB C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1 705803 SLCAPPSOGCMOQX-CFTTWAEZSA-N 355.401 2.633 50 40 FFGB C=CCc1cccc2cc(C(=O)NNC(=O)c3ccc(C)cc3)c(=O)oc12 4263316 CHVRRZKQSZEXMH-UHFFFAOYSA-N 362.385 2.905 50 40 FFGB CCN(CC)N(C(C)=O)[C@@H]1C[C@H](c2ccccc2)C(C#N)(C#N)C1(C#N)C#N 2273538 APBGEMOUPARITI-RTBURBONSA-N 374.448 2.715 50 40 FFGB C[C@@H](C(=O)C(C#N)=C1Nc2ccccc2N1)N1C(=O)c2ccccc2C1=O 5595714 XKGLLASWZOPLIJ-NSHDSACASA-N 358.357 2.513 50 40 FFGB O=C(NN=C1CCN(Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] 57394789 UHBOSDKESLPUCB-UHFFFAOYSA-N 352.394 2.977 50 40 FFGB COC(=O)/C(C#N)=C/c1cccc(OC(=O)c2ccccc2[N+](=O)[O-])c1 1791139 IZRASTICKVEMAB-UKTHLTGXSA-N 352.302 2.894 50 40 FFGB COc1cc(/C=N/NC(=O)CSc2ccccc2)cc(OC)c1OC 59147791 KOKXMYRCLCVLRQ-YBFXNURJSA-N 360.435 2.955 50 40 FFGB O=C(N/N=C\c1c(O)ccc2ccccc12)c1cc([N+](=O)[O-])ccc1O 408918466 KVQMNNRDUPLQTJ-GRSHGNNSSA-N 351.318 2.923 50 40 FFGB C/C(CC(=O)Nc1cccc(C)n1)=N\NC(=O)COc1ccc(Cl)cc1 5394582 QCFLBVNAPNANEF-LPYMAVHISA-N 374.828 2.943 50 40 FFGB CC(C)(C)OC(=O)COc1ccc(/C=N/NC(=O)c2cccnc2)cc1 4502875 QUJVJVOUTJZFGG-SRZZPIQSSA-N 355.394 2.566 50 40 FFGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)S(=O)(=O)c1ccccc1 6829613 ISUCRIZJTLBKQV-AWNIVKPZSA-N 358.331 2.662 50 40 FFGB Cc1cc2c(c(=O)[nH]1)[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1480492 QQTHHGGEFMOCQE-ZDUSSCGKSA-N 358.195 2.664 50 40 FFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\Nc1cc(C)c(C)cc1Br 6295194 YTNHDVDJHUMKPZ-GHXNOFRVSA-N 360.211 2.858 50 40 FFGB CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2ccc(F)cc2)cc1 36393932 RFPPEYWFIUWNOD-UHFFFAOYSA-N 357.429 2.671 50 40 FFGB Cc1ccccc1C[C@@H]1S/C(=C(\C#N)C(N)=O)N(c2ccccc2)C1=O 2376701 WTIFUCLUFDINKP-BJMRFWQKSA-N 363.442 2.907 50 40 FFGB C[C@H](NC(=O)C(=O)N/N=C/c1cccc(Br)c1)c1ccccc1 3147931 USEAHTSGJONCJL-MKFNJMOCSA-N 374.238 2.777 50 40 FFGB Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1 6841561 ZGLDXQUZZFABFF-CYBMUJFWSA-N 362.813 2.642 50 40 FFGB O=C(COc1ccccc1F)NNC(=O)Cc1c(Cl)cccc1Cl 5273033 RAEVOJWCTQWPPN-UHFFFAOYSA-N 371.195 2.901 50 40 FFGB COc1cc([N+](=O)[O-])cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c1O 4525122 VVQYPQUBQMIWAR-WDZFZDKYSA-N 355.306 2.560 50 40 FFGB Cc1ccccc1N(CC(=O)NN=C1CCCCCC1)S(C)(=O)=O 6207917 CGMJEHXSUWFOIW-UHFFFAOYSA-N 351.472 2.587 50 40 FFGB Cc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(N)=O)c(C)c1 5529482 NTZGNKBICFDZJK-XNTDXEJSSA-N 374.400 2.804 50 40 FFGB O=c1c2ccccc2n2c(CCl)nnc2n1Cc1ccc2c(c1)OCO2 408712708 JVHHMOWVIQFTCO-UHFFFAOYSA-N 368.780 2.560 50 40 FFGB COc1cc(/C=N\NC(=O)COc2cc(C)ccc2C)cc(OC)c1OC 30732555 QKQYVHDNPOWPJX-NHDPSOOVSA-N 372.421 2.858 50 40 FFGB COc1cccc(/C=N\NC(=O)[C@H](C)Oc2cccc3cccnc23)c1O 12364820 LCRAEQORPSIKHJ-QGNWGPJTSA-N 365.389 2.867 50 40 FFGB C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(F)c3)cc2C1 7403167 IHRLCBSWIYQLAC-JTQLQIEISA-N 368.455 2.635 50 40 FFGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=CCC[C@H]2[C@@H]1c1ccc(OC)cc1 20470023 RJCZKWNAUSKZQS-MMOPVJDHSA-N 363.417 2.938 50 40 FFGB Cc1ccc(OCC(=O)n2c(C)c(C(=O)NN)c3ccccc32)cc1C 218738392 DKKCEZSHPDSCTA-UHFFFAOYSA-N 351.406 2.889 50 40 FFGB Cc1ccc(/C=N\NC(=O)Cn2cnc3sc(C)c(C)c3c2=O)cc1 31783402 IKQHMSJYTCLBBG-ZBKNUEDVSA-N 354.435 2.534 50 40 FFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)ccc1O 832743 FQDMKTHUGMFLEI-MRXNPFEDSA-N 362.341 2.725 50 40 FFGB biogenic O=C(CCl)NCCN1C(=O)S/C(=C\c2ccccc2Cl)C1=O 3250330 MMNJZTLOJQQFRT-XFFZJAGNSA-N 359.234 2.731 50 40 FFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3)CC2)cc1 409006421 NSZPARYGJHPNDA-PXLXIMEGSA-N 365.433 2.698 50 40 FFGB N#C/C(C(=O)NCCc1c[nH]c2ccccc12)=C1/C(=O)Nc2ccccc21 408854602 ACKABZIXIHITRB-MNDPQUGUSA-N 356.385 2.756 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1 408969735 SPXZNZYJZSSUGA-PCXKXAPESA-N 353.422 2.630 50 40 FFGB CNC(=O)/C(C#N)=C\c1cccc(OCC(=O)Nc2ccc(C)c(C)c2)c1 409008576 YCVVLVJKGQVBHV-YVLHZVERSA-N 363.417 2.974 50 40 FFGB Cc1cc(/C=C(/C#N)C(=O)N2CCOCC2)c(C)n1-c1ccc(F)cc1 42629272 YMSXYPMZTPYDMA-ATVHPVEESA-N 353.397 2.999 50 40 FFGB CC(NCCN1C(=O)S/C(=C\c2ccccc2F)C1=O)=C(C#N)C#N 6313090 OWKSKYMEIYBHBQ-NVNXTCNLSA-N 356.382 2.773 50 40 FFGB O=C(N/N=C\c1cc(O)ccc1[N+](=O)[O-])c1cc2ccccc2cc1O 35409457 CJBZZTGVNGNXRD-GRSHGNNSSA-N 351.318 2.923 50 40 FFGB O=C(NNC(=O)c1cccs1)c1ccc(NC(=O)c2ccco2)cc1 9390036 JLBXUOZDIJGYJC-UHFFFAOYSA-N 355.375 2.668 50 40 FFGB CC(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc3c(c2)OCO3)cc1 5413438 MSDJTYLBCWFFEB-KEBDBYFISA-N 353.378 2.628 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)ccc1OCC(=O)O 5512800 RQVPLBSFUHYYSF-DJKKODMXSA-N 362.769 2.576 50 40 FFGB CN1c2ccccc2C2=C([C@H](c3ccsc3)C(C#N)=C(N)O2)S1(=O)=O 20558358 NBFOYQAHCSQBSB-CQSZACIVSA-N 371.443 2.704 50 40 FFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)COc1ccc2ccccc2c1 4737457 PCJKAUOJFVRAKD-UHFFFAOYSA-N 359.385 3.000 50 40 FFGB CCc1ccc(/C=N/NC(=O)Cn2ccc(C(F)(F)F)n2)cc1[N+](=O)[O-] 7785965 KAYIVZBSAQETEM-UFWORHAWSA-N 369.303 2.523 50 40 FFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 17075038 AADDLHYQDPZXLR-JAIQZWGSSA-N 365.349 2.757 50 40 FFGB N#C/C(=C/c1ccc(OCC(N)=O)cc1)C(=O)Nc1ccccc1Cl 212349803 QSGJFKXDCKMAAV-LCYFTJDESA-N 355.781 2.750 50 40 FFGB O=C1C=C(NNC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)C1 5684655 DGDZTEPFAZRGBT-MRXNPFEDSA-N 365.389 2.789 50 40 FFGB Cc1[nH]c2ccccc2c1CC(=O)NNC(=O)Cc1c[nH]c2ccccc12 24569233 OQEKYEPDPCHXOX-UHFFFAOYSA-N 360.417 2.890 50 40 FFGB Cc1ccc(NCC(=O)NNC(=O)c2ccccc2C(F)(F)F)cc1 12543641 FWMCFDUSQZIJGI-UHFFFAOYSA-N 351.328 2.887 50 40 FFGB Cc1ccccc1C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1 9201574 GEXQZAPWOXBGBW-DEDYPNTBSA-N 368.393 2.504 50 40 FFGB CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NN(C)c2ccccc2)cc1 11354921 OTRHQZCTFRGNHQ-AWEZNQCLSA-N 361.467 2.545 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(N2CCCCC2)o1 4551582 QVWMFPDNJWSDFB-CPNJWEJPSA-N 356.382 2.871 50 40 FFGB CCC(=O)NNc1ncnc2c1cnn2-c1ccc(Cl)c(Cl)c1 7443203 UJFPSXVKWQELEL-UHFFFAOYSA-N 351.197 2.975 50 40 FFGB COc1ccc(OC)c(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c1 408542756 KXBMMSVSOOYFAJ-ZSOIEALJSA-N 352.346 2.948 50 40 FFGB N#C/C(=C/N1CCN(c2ccccc2)CC1)C(=O)NCCc1ccccc1 102820830 OLOIMLMWDNCTLN-ZZEZOPTASA-N 360.461 2.575 50 40 FFGB COC(=O)c1ccc([C@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC(C)C)cc1 808925 CJDWCABBJHXZRG-INIZCTEOSA-N 356.378 2.506 50 40 FFGB CCc1ccc(OCC(=O)NNC(=O)CCCOc2cccc(C)c2)cc1 7640031 CESSLSVSWPRWSI-UHFFFAOYSA-N 370.449 2.943 50 40 FFGB CC1(C)C(=O)[C@]2(Br)CC[C@]1(CC(=O)O)[C@@H]2Br 103708668 OUDQDORDQBJHEI-SWPVVBRQSA-N 354.038 2.747 50 40 FFGB O=C(OCc1ccccc1)N1CC[C@H](CN(C(=O)CCl)C2CC2)C1 79392756 GXSPIXCNUNNWJI-HNNXBMFYSA-N 350.846 2.875 50 40 FFGB CCS(=O)(=O)[C@@H](I)[C@@H](O)c1cccc(Cl)c1 96519239 KAADRHASOWQEQP-VHSXEESVSA-N 374.627 2.569 50 40 FFGB COc1cc(Br)cc(/C=C(\C#N)C(=O)NC2CC2)c1OC 1102577 HEPBMGDMUPPWLF-BJMVGYQFSA-N 351.200 2.652 50 40 FFGB COc1cc(OC)cc(C(=O)NNc2nc3cc4c(cc3s2)OCO4)c1 4121505 LAEWGWKSDCVSMR-UHFFFAOYSA-N 373.390 2.799 50 40 FFGB N#CC1=C(SCC(=O)N2CCCCC2)NC(=O)C[C@H]1c1ccc(F)cc1 6495387 YLHJFACUQAHXRB-HNNXBMFYSA-N 373.453 2.910 50 40 FFGB O=C(N/N=C/c1cc(Br)c(O)c2ncccc12)c1ccncc1 59459141 MOMLXKIXHJEOQJ-AWQFTUOYSA-N 371.194 2.862 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1ccc(OCC(=O)O)c(Cl)c1 59249079 BRCJYBMXJSVTJM-DJKKODMXSA-N 362.769 2.576 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1c1cc([N+](=O)[O-])cs1 2500607 PRJQAGYKKWMYQS-ZDUSSCGKSA-N 367.342 2.981 50 40 FFGB C#CCOc1c(Br)cc(/C=C(/C#N)C(N)=S)cc1OC 408542570 JSMUWOVTYJLRMV-YHYXMXQVSA-N 351.225 2.663 50 40 FFGB O=C(NN=C1CCCCC1)C1CCN(S(=O)(=O)c2cccs2)CC1 5576964 QTWCEVLDTWHNIL-UHFFFAOYSA-N 369.512 2.585 50 40 FFGB O=C(CCl)N(c1cc(Cl)cc(Cl)c1)[C@@H]1CCS(=O)(=O)C1 40177570 BXRINKAKAHCGHF-SNVBAGLBSA-N 356.658 2.752 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)N2CCCC2)c(C)n1-c1cccc(Cl)c1 58912486 XZZCVLSDHBKKGB-CIAFOILYSA-N 372.856 2.820 50 40 FFGB Cc1cc(C(=O)N/N=C/c2cccc(OC(=O)c3cccs3)c2)[nH]n1 3901269 VJZIFOCZOKUFBH-VCHYOVAHSA-N 354.391 2.763 50 40 FFGB O=C(NCCc1ccco1)NNC(=O)c1ccc(COc2ccccc2)o1 9533216 NEOOVKXGTTWNRG-UHFFFAOYSA-N 369.377 2.638 50 40 FFGB CCn1c(NNC(=O)[C@@H](C)Oc2ccc(C)cc2)nc2ccccc2c1=O 10680857 YYGCLHBVNUGXOW-CQSZACIVSA-N 366.421 2.635 50 40 FFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccccc1C(=O)O 20246281 CIFLFRQHRYETOG-GIJQJNRQSA-N 373.390 2.677 50 40 FFGB COc1ccccc1OCC(=O)N/N=C\c1ccc(N2CCCC2)c(F)c1 409104986 LSXUWZZQWVAZMZ-XKZIYDEJSA-N 371.412 2.964 50 40 FFGB C/C(=N\NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O)c1ccc(C)cc1 408921365 GWBPASJBLGUANV-WLVMFVESSA-N 373.478 2.690 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1cc2c(s1)-c1ccccc1OC2 96447708 SSYAZVMTYVZHRT-RAXLEYEMSA-N 354.387 2.790 50 40 FFGB C/C(CC(=O)NC[C@@H]1CCCO1)=N\NC(=O)c1ccc(C(C)(C)C)cc1 101512555 GVFKMIXAWNUGPF-NIZGNDASSA-N 359.470 2.775 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 104654130 KWWYTJBDJJMHJQ-ATVHPVEESA-N 355.369 2.715 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2cc(C)ccc2C)c1C 58913980 JJZQTBVMHBJEKI-QRVIBDJDSA-N 366.465 2.853 50 40 FFGB CCOc1ccc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)c(O)c1 4735453 FALITLQOMIXKFZ-UDWIEESQSA-N 358.394 2.501 50 40 FFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCC(=O)c2cccs2)c1C 6983896 INDAORHFZFBRLV-AWEZNQCLSA-N 374.462 2.943 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1 409248896 FWAIWYLLHWCVSZ-ORWNMUSCSA-N 365.433 2.815 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)ccc1O 33340226 UFLYIMNMXZJHFP-LGMDPLHJSA-N 363.417 2.657 50 40 FFGB O=C(CCCCC(=O)N/N=C/c1ccccc1)N/N=C\c1ccccc1 33906893 HCIIKBJMNCAZCI-KBNZVFGVSA-N 350.422 2.847 50 40 FFGB N#CC1=C(N)N2C(=C(C#N)[C@@]13C(=O)Nc1ccccc13)Sc1ccccc12 49947099 MQEURGSJMMOHFH-FQEVSTJZSA-N 369.409 2.931 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2cc(-c3cccn3C)n[nH]2)cc1OC 16137026 DRXXXYIFANWEJB-UDWIEESQSA-N 367.409 2.586 50 40 FFGB O=C(NNC(=S)N[C@H]1C[C@H]2CC[C@H]1C2)c1cc2ccccc2cc1O 104272704 RZYXNMQTKTXISR-PJODQICGSA-N 355.463 2.843 50 40 FFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\Nc1ccc(Br)c(Cl)c1 100948478 HOSCQGHRVCNLRW-POHAHGRESA-N 366.602 2.895 50 40 FFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1c(C)nn(C)c1C 25955886 ILKPEDHBALKHHX-UHFFFAOYSA-N 369.450 2.544 50 40 FFGB Cc1ccccc1C(=O)NNC(=O)c1cnn2c(-c3ccccc3)ccnc12 40144690 JDANGIXYBGIXAP-UHFFFAOYSA-N 371.400 2.780 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C/c1cc(OC)ccc1OC 20100900 MLPBYUADAQVCQU-UDWIEESQSA-N 358.394 2.632 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2ccc(O)c(OC)c2)cc1 59473464 SHEYRRJYILJKEH-VXLYETTFSA-N 360.435 2.793 50 40 FFGB C#CCOc1ccccc1/C=N\NC(=O)c1ccc(OCC)c(OC)c1 35612274 CCBMNSAKTTWGKB-STZFKDTASA-N 352.390 2.870 50 40 FFGB O=C(NNc1ncccn1)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1 45075899 CREFAWXIEKMWAF-GOSISDBHSA-N 358.405 2.927 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1[N+](=O)[O-] 3140031 GXZMGKNFRISQDI-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB O=S(=O)(/N=c1\cccc[nH]1)c1ccc(N(CCCl)CCCl)cc1 6013569 KDVLUOGTEOXWMD-UHFFFAOYSA-N 374.293 2.588 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1cccs1 101503509 DCYHIECKEMMKQF-YBFXNURJSA-N 359.407 2.654 50 40 FFGB O=C(COC(c1ccccc1)c1ccccc1)NNC(=O)c1ccccn1 32896180 CSXKHDXRJAOVJB-UHFFFAOYSA-N 361.401 2.649 50 40 FFGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2O)o1)c1cccnc1 408722838 NUAWUVNNBWODRW-VXLYETTFSA-N 352.306 2.719 50 40 FFGB COC(=O)c1ccc(/C=N\NC(=O)c2ccc(Br)cc2)cc1 33399632 GEMUTGXPCLSNNZ-ZDLGFXPLSA-N 361.195 3.000 50 40 FFGB CCS(=O)(=O)[C@@H](Br)C(=O)c1ccc(Br)cc1 96517866 RQAAZUVOLBAJAQ-SNVBAGLBSA-N 370.062 2.788 50 40 FFGB COc1ccc(/C=N/NC(=O)c2c(C)nc3cc(C)ccn23)cc1[N+](=O)[O-] 59435657 YHLNXLVXDNFWNN-VXLYETTFSA-N 367.365 2.632 50 40 FFGB CCC(=O)NNc1ccc(C(=O)Nc2ccc(OC)cc2)cc1[N+](=O)[O-] 4524347 JEJYFVQULGHCDD-UHFFFAOYSA-N 358.354 2.709 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)c2cccc(NC(C)=O)c2)cc1OC 408842408 ORRJIERBCLZZIX-LPYMAVHISA-N 369.421 2.745 50 40 FFGB Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)NC(=O)C(C)(C)O3)cc1 15935947 WNYIZVAORJGXCZ-UHFFFAOYSA-N 368.393 2.571 50 40 FFGB NNC(=O)c1cn(C(=O)c2ccccc2Br)c2ccccc12 226366365 GBCJUSSFBUGUSM-UHFFFAOYSA-N 358.195 2.696 50 40 FFGB C/C(CC(=O)N(C)c1ccccc1)=N\NC(=O)COc1ccccc1C 4405666 VDAXFLVWJHRZPG-LTGZKZEYSA-N 353.422 2.919 50 40 FFGB COc1ccc2c(c1)cc(C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)n2C 2273565 LVZXGJIOKJFXPK-YBFXNURJSA-N 352.350 2.859 50 40 FFGB COc1ccc(CCNC(=O)/C(C#N)=C\c2ccc(C#N)cc2)cc1OC 33471969 RLWPDCBKOHAVFK-WQRHYEAKSA-N 361.401 2.841 50 40 FFGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(OC)cc2OC)cc1 1052314 RAAWCOXSZLREBG-UDWIEESQSA-N 355.394 2.816 50 40 FFGB CC[C@@H]1CCc2sc(C(=O)NNC(=S)NC[C@@H]3CCCO3)cc2C1 7974442 VLXIWWWCXHZMOL-YPMHNXCESA-N 367.540 2.551 50 40 FFGB COc1cc([N+](=O)[O-])cc(/C=C(/C#N)C(=O)NCc2ccccc2)c1O 408748109 YLCVTRWWJQXRNV-AUWJEWJLSA-N 353.334 2.532 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)ccc1OCC(C)C 7159857 YGKFOIWRSUHBFY-JDZKTDJGSA-N 358.438 2.932 50 40 FFGB CCOC(=O)c1csc(N(NC(C)=O)C(=O)Nc2ccc(C)cc2)n1 1415210 PCVJBXJVSLQKFA-UHFFFAOYSA-N 362.411 2.718 50 40 FFGB CCOc1cc(/C=N\NC(=O)c2c(C)nc3cc(C)ccn23)ccc1O 59515852 CAZAHNXUYXCXHF-JAIQZWGSSA-N 352.394 2.819 50 40 FFGB N#C/C(C(N)=O)=C1/S[C@H](Cc2ccc(F)cc2)C(=O)N1c1ccccc1 2327961 IGIOFTOWUNDNPY-URTGMZOISA-N 367.405 2.737 50 40 FFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1cccc(Br)c1 13844228 LGXPQJJNNKWKSD-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CCOC(=O)/C(C#N)=C/c1ccc(-c2cc(C(=O)O)cc(C(=O)O)c2)o1 4544214 BVUYCWYNZAVJBF-MDWZMJQESA-N 355.302 2.813 50 40 FFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1ccc(F)nc1 72284116 LCDOLJAIKDUVMD-UHFFFAOYSA-N 365.364 2.728 50 40 FFGB NC(=S)NNC(=O)/C=C/c1ccc(OCc2ccccc2Cl)cc1 62715576 CHJWNUUKIHSONR-JXMROGBWSA-N 361.854 2.797 50 40 FFGB O=C(O)[C@H](Br)Cc1ccc(I)cc1 225012519 AVRIYQQWTMXGRF-MRVPVSSYSA-N 354.969 2.682 50 40 FFGB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)O)[C@@H]2C(=O)NNC(=O)c1sccc1C 5603310 FCUZTBBHXJMZQL-ZMJPVWNMSA-N 362.451 2.511 50 40 FFGB O=C(N/N=C/c1coc2ccc(Cl)cc2c1=O)c1cc(O)cc(O)c1 5945528 DVDHQBQYQQEKRS-FBCYGCLPSA-N 358.737 2.622 50 40 FFGB COCc1cc(C)nc(OCC(=O)N/N=C/c2ccccc2Cl)c1C#N 13282378 RLDFNKDBFRRTMF-ZVBGSRNCSA-N 372.812 2.591 50 40 FFGB CCOc1ccc(OCCCC(=O)NNC(=O)c2ccccc2F)cc1 2658185 MVWGDKUKDOXIDC-UHFFFAOYSA-N 360.385 2.845 50 40 FFGB Cc1cccc(NCC(=O)N/N=C\c2c(C)nn(-c3ccccc3)c2O)c1 4869716 IJKMIWXGNJFOGG-UUYOSTAYSA-N 363.421 2.757 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2cc3cc(Cl)ccc3oc2=O)cc1 10384440 JASXCDJRAILNBC-UHFFFAOYSA-N 356.765 2.830 50 40 FFGB O=C(Cc1ccccc1)NNC(=O)c1cc(C2CC2)nn1-c1ccccc1 13004238 KBLIOXJAHKIAPS-UHFFFAOYSA-N 360.417 2.753 50 40 FFGB O=C(NNC(=O)c1cccc(Cl)c1)c1ccc(Cn2cccn2)cc1 14046479 HOCAITPMSBIUSS-UHFFFAOYSA-N 354.797 2.660 50 40 FFGB C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(OCC)c1OCC(=O)O 408767001 HRTLMNYRVPIORY-SXGWCWSVSA-N 372.421 2.709 50 40 FFGB COc1ccc(NC(=O)N/N=C\c2ccc(O[C@@H](C)C(=O)O)cc2)cc1 408851525 ZYNNCURPCBWYRV-XHEYCZLTSA-N 357.366 2.703 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2cc([N+](=O)[O-])ccc2O)c(OCC)c1 409049761 YIBHKRASQBNMRB-YBFXNURJSA-N 373.365 2.862 50 40 FFGB CCn1ncc(/C=N/NC(=O)COc2ccc3cc(OC)ccc3c2)c1F 252487691 HZULQADBZXARGD-UFFVCSGVSA-N 370.384 2.733 50 40 FFGB O=C(COc1ccc(Cl)cc1)NNC(=O)COc1ccc(Cl)cc1 5569929 RDKDYTVSHLIKSP-UHFFFAOYSA-N 369.204 2.599 50 40 FFGB Cc1csc(CC(=O)NNC(=O)C(c2ccccc2)c2ccccc2)n1 32858286 FPFYURRTLVUCIJ-UHFFFAOYSA-N 365.458 2.974 50 40 FFGB Nc1nc(SCC(=O)NNc2c(Cl)cc(Cl)cc2Cl)n[nH]1 12487558 OWLKGRITIIBQHV-UHFFFAOYSA-N 367.649 2.583 50 40 FFGB O=C(Cn1cnc2sc3c(c2c1=O)CCCC3)N/N=C/c1cccs1 958314 ZOEDOVNTNQJHMI-UFWORHAWSA-N 372.475 2.549 50 40 FFGB C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/C1=Cc2ccccc2O[C@@H]1C 2373830 MVRQREBAXNWAMR-HPXDRZRRSA-N 359.426 2.866 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cccn2-c2cccc(C(=O)O)c2)cc1 409092861 ZYFZVESTXZIOSC-FYJGNVAPSA-N 363.373 2.948 50 40 FFGB O=C(NNC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1ccccn1 8747648 DPOHHOHVPNJLQS-UHFFFAOYSA-N 369.384 2.767 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(C)cc2)c1C 408940946 OVTSNJJJLICZBX-STCDJXRXSA-N 354.454 2.767 50 40 FFGB CCOc1cc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)ccc1O 40545755 NCKYDJHWIXMVAD-SFHVURJKSA-N 352.346 2.738 50 40 FFGB CSc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 8169579 JIFZWZYGFNXEDQ-RVZJCZPVSA-N 353.447 2.912 50 40 FFGB N#C/C(=C\c1cn(CC(=O)Nc2ccc(F)cc2)c2ccccc12)C(N)=O 876455 JGZFRHDCCBYNTP-UKTHLTGXSA-N 362.364 2.811 50 40 FFGB NNC(=O)c1ccccc1NC(=O)CSc1nc2ccccc2s1 1565019 VYJUYYZPAAENAK-UHFFFAOYSA-N 358.448 2.631 50 40 FFGB NC(=O)Cn1cc(/C=N/NC(=O)c2cccc(Cl)c2)c2ccccc21 6816711 HRUXNGVURLNDND-ZVBGSRNCSA-N 354.797 2.544 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)cc2)cc1OC 7869797 LDNZVBRWXGRSQR-FYJGNVAPSA-N 367.405 2.657 50 40 FFGB CC(C)(C)CC(=O)N1CCC(=NNC(=O)c2ccc3c(c2)OCCO3)CC1 60420661 PEVYDVKUSGOHEV-UHFFFAOYSA-N 373.453 2.602 50 40 FFGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)cc1 4599710 CMFZWESQHMQLLH-GXDHUFHOSA-N 350.330 2.717 50 40 FFGB C=CCOC(=O)C1=C(C)NC(S)=C(C#N)[C@@H]1c1ccc(C(=O)OC)cc1 19851952 XIOWSNNOBDJWLX-INIZCTEOSA-N 370.430 2.828 50 40 FFGB CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccc2nccnc2c1 15987265 DESZYBAXHBKNHR-CNPYVQQSSA-N 371.441 2.629 50 40 FFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)N2CCCCC2)c1C 408972725 VQYZYNNOTYUGIA-HYARGMPZSA-N 366.465 2.865 50 40 FFGB COc1ccccc1NC(=O)N/N=C\c1ccc(N2CCOCC2)c(F)c1 409142314 KNRJGZFGYNZRSG-BKUYFWCQSA-N 372.400 2.827 50 40 FFGB O=C(NNS(=O)(=O)/C=C/c1ccccc1)c1cc2c(s1)CCCC2 12761522 HTAFDESTQZZUMT-ZHACJKMWSA-N 362.476 2.862 50 40 FFGB O=C(N/N=C/c1ccc(Cl)cc1Cl)c1ccc(-n2cnnn2)cc1 6652236 JLMAFTRGTMQTBO-QGMBQPNBSA-N 361.192 2.733 50 40 FFGB COC(=O)c1ccc(C(=O)O)cc1P(c1ccccc1)c1ccccc1 100221673 WCXGUPASMSAFGS-UHFFFAOYSA-N 364.337 2.930 50 40 FFGB C[C@@H](C(=O)N/N=C/c1cccc(Br)c1)n1nnc2ccccc21 994075 JXQTZJMGNXQKIJ-HPAYWCODSA-N 372.226 2.905 50 40 FFGB O=C(CCc1ccccc1)N/N=C/c1cc([N+](=O)[O-])c(O)c2ncccc12 59459159 JACUPWNJMZAQAQ-CIAFOILYSA-N 364.361 2.932 50 40 FFGB COc1cc(Cl)c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1OC 408735117 OCRFEGAQSYQGLL-XEVNVYFWSA-N 350.802 2.559 50 40 FFGB COc1ccc(OCC(=O)N/N=C(\C)c2cccc(NC(C)=O)c2)cc1 6684580 QJIFPBJCHRLLDO-FYJGNVAPSA-N 355.394 2.573 50 40 FFGB C[C@@H](CCl)CS(=O)(=O)Nc1cccc(I)c1 72312169 VYPZNFPHEVBNJF-QMMMGPOBSA-N 373.643 2.908 50 40 FFGB CC(=O)O[C@H]1C[C@H]2[C@H](Br)[C@@H]1NC2(C(F)(F)F)C(F)(F)F 33742215 RMADYUJTAOPBEY-ZTYPAOSTSA-N 370.087 2.537 50 40 FFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccc(Br)cc1O 1073966 MMCYCMMANMFZDQ-REZTVBANSA-N 363.167 2.647 50 40 FFGB COc1ccccc1/C=C(\C#N)C(=O)NCCc1ccc(OC)c(OC)c1 3328696 ZQBJCWGKMURJJN-GHRIWEEISA-N 366.417 2.978 50 40 FFGB N#CC1=C(N)N2C(=C(C#N)[C@H]1c1ccc3c(c1)OCO3)Nc1ccccc12 2252048 RPOAHSBEEMGVTD-SFHVURJKSA-N 355.357 2.874 50 40 FFGB Cc1ccc(C(=O)NN[C@@H]2CC(=O)N(c3ccc(Cl)c(C)c3)C2=O)cc1 2234288 BGVCRGSURCCURT-MRXNPFEDSA-N 371.824 2.523 50 40 FFGB O=C(CCNC(=O)c1ccccc1Cl)N/N=C/c1ccccc1[N+](=O)[O-] 2675802 PLDGXRBHESSCLM-RGVLZGJSSA-N 374.784 2.518 50 40 FFGB COc1cc(Cl)c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1OC 408735115 OCRFEGAQSYQGLL-UWUHSAQLSA-N 350.802 2.559 50 40 FFGB Cc1ccc(N2C[C@H](C(=O)N/N=C/c3ccccc3O)CC2=O)cc1C 409164109 CLIAYZFOBQIBSN-BTZNOAQDSA-N 351.406 2.512 50 40 FFGB CCOc1ccc2[nH]c(=O)c(/C=N/NC(=O)c3ccccc3OC)cc2c1 32608418 SCAJILKXOBKBJF-CIAFOILYSA-N 365.389 2.699 50 40 FFGB O=C(Cn1nc(C(F)(F)F)c2c1CCC2)N/N=C/c1ccc(F)s1 252482618 DLADXNYGUYULBS-KPSZGOFPSA-N 360.336 2.742 50 40 FFGB O=C(COc1ccc(/C=N/NC(=O)c2ccncc2)cc1)Nc1ccccc1 832766 NCGHKZVHFNDIAA-OEAKJJBVSA-N 374.400 2.863 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(O)c(Cl)c2)n1 8336670 VCODTSGAAHQFJT-REZTVBANSA-N 350.831 2.695 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2)cc1OC 5480022 GOLUPXLQJNLMOJ-XDHOZWIPSA-N 357.366 2.695 50 40 FFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2cccnc2)cc1Cl 100813040 ZLIPWWPQFRAIDA-SRZZPIQSSA-N 360.801 2.878 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)N[C@@H](C)c2ccccc2)c1 59501688 OKDRZJJZWSGNPD-HBBMIWKISA-N 351.406 2.579 50 40 FFGB Cc1ccsc1C(=O)NNC(=O)COc1ccc(Br)cc1 3395493 LLHHMDVELFNACB-UHFFFAOYSA-N 369.240 2.659 50 40 FFGB Cc1ccc(C(=O)/C=C(\O)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 100795175 QMXTXZYGKPQKNV-ALAONZSNSA-N 353.334 2.678 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc(OC)c1O 6639627 TYMUEBZUJAOSEA-NTUHNPAUSA-N 368.345 2.653 50 40 FFGB Cc1cc(C(=O)NNC(=O)C(O)(c2ccccc2)c2ccccc2)cs1 858898 NIJKGXUMFAPWQT-UHFFFAOYSA-N 366.442 2.754 50 40 FFGB CC(C)c1ccc(/C=C/C(=O)NNC(=O)COc2ccccc2C#N)cc1 6981813 KXXBRWTZWMTJJT-FMIVXFBMSA-N 363.417 2.921 50 40 FFGB CC1(C)[C@@]2(C(=O)O)CC[C@]1(C)/C(=N/NC(=O)c1ccc(Cl)cc1)C2=O 5072005 PBDYJAHQGQMCFY-SLCIEKFFSA-N 362.813 2.906 50 40 FFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1ccc([N+](=O)[O-])o1 4515187 QERPWYWJQBRAAC-OVCLIPMQSA-N 352.144 2.643 50 40 FFGB O=C(N/N=C/c1ccco1)C1CCN(C(=O)c2ccccc2Cl)CC1 409006387 NNHFLQRYEBYMLD-UDWIEESQSA-N 359.813 2.936 50 40 FFGB CCCOc1cc(OC)ccc1[C@@H]1C(C#N)=C(N)Oc2oc(C)cc(=O)c21 5793607 MFYZGXCNOXFYLM-QGZVFWFLSA-N 368.389 2.964 50 40 FFGB O=C(COc1cccc2cccnc12)NNC(=S)Nc1ccccc1 3638933 LKNRADYNDJFLSI-UHFFFAOYSA-N 352.419 2.631 50 40 FFGB O=C(NNC(=O)c1ccco1)c1ccc(NC(=O)C2CCCCC2)cc1 1088053 VZNCNCWOCRCHBP-UHFFFAOYSA-N 355.394 2.873 50 40 FFGB NC(=O)N/N=C/c1ccccc1OC(=O)c1ccccc1Br 1464832 VJOMMDFKASSPNP-GIJQJNRQSA-N 362.183 2.671 50 40 FFGB Cc1nc2ccc(Br)cn2c1C(=O)N/N=C\c1ccncc1 59459689 ZURYUGWIGNGSPF-LSCVHKIXSA-N 358.199 2.564 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc1 409055214 XMPOUVLGAVUONQ-KEBDBYFISA-N 360.797 2.964 50 40 FFGB C/C(=N\NC(=O)[C@@H](C)Oc1ccc2c(c1)CCC2)c1cc(O)ccc1O 13321852 GKWFHHVYFUMMKW-LNOXHEFASA-N 354.406 2.894 50 40 FFGB CC[C@H](Nc1ccccc1)C(=O)N/N=C/c1cc(OC)cc([N+](=O)[O-])c1O 36047256 NAGVLXCUWTZXHB-BKQORJHRSA-N 372.381 2.650 50 40 FFGB O=C(N/N=C\c1ccc(Cl)cc1)C(=O)N/N=C\c1ccc(Cl)cc1 31637157 VKIHCVACQCOVEO-QJUDHZBZSA-N 363.204 2.594 50 40 FFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/NNC(=O)c1ccc(O)cc1 100927552 JORMBOPYJDGZLK-MHWRWJLKSA-N 370.796 2.587 50 40 FFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)oc(=O)c32)ccc1OC(C)C 809386 RQOLJJWJRQDNLR-KRWDZBQOSA-N 368.389 2.962 50 40 FFGB O=C(CCCCCC(=O)OCCBr)OCCBr 4721926 DEFWAHSZWUZXIZ-UHFFFAOYSA-N 374.069 2.813 50 40 FFGB CCCCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2ccco2)c2ccccc21 5243600 YQUQECIIRWKOBZ-ICFOKQHNSA-N 362.389 2.621 50 40 FFGB COc1nc2ccccc2cc1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 6453534 JFCMVTPRUHLWBP-YBFXNURJSA-N 350.334 2.916 50 40 FFGB COC(=O)c1cccc(C(=O)[C@H](Br)CBr)c1 309413209 GNAWJOZTDYGXTM-SECBINFHSA-N 350.006 2.814 50 40 FFGB O=C(NNc1ccnc2cc(Cl)ccc12)c1ccc(-n2cnnn2)cc1 8133441 QMWYDXJNHIUJNY-UHFFFAOYSA-N 365.784 2.621 50 40 FFGB CCc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1 408677506 BZUUVJPOVIVQMP-LACSLYJWSA-N 364.239 2.759 50 40 FFGB Cc1cccc(/C=N/NC(=O)CN(c2cc(C)cc(C)c2)S(C)(=O)=O)c1 408781807 DVWZKQITQCOFRP-UDWIEESQSA-N 373.478 2.528 50 40 FFGB C/C(=N\NC(=O)CNC(=O)/C=C/c1ccco1)c1cccc2c1CCCC2 5005899 PRMCTUWTBQRHAV-KBNLXNBLSA-N 365.433 2.828 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(N3CCCC3)cc2)n1 4123783 XVXIJLGFQQISPR-UDWIEESQSA-N 369.494 2.936 50 40 FFGB COc1ccc(Br)cc1/C=C(\C#N)C(=O)NC[C@@H]1CCCO1 6209742 HZNBUMQANXATTI-GMMCIKNFSA-N 365.227 2.660 50 40 FFGB O=C(CCC(=O)Oc1ccc([N+](=O)[O-])cc1)Oc1ccc([N+](=O)[O-])cc1 3194266 HKJFYVRDQXGPPK-UHFFFAOYSA-N 360.278 2.794 50 40 FFGB CN1[C@@H]2[C@H](Br)CCCCN2c2ccc(F)cc2S1(=O)=O 8132304 OOTIIPYEXYSBQL-MFKMUULPSA-N 363.252 2.540 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\C=C\c1ccccc1[N+](=O)[O-] 107607196 PQHBGWNLSCPQHH-ZMCAKAGVSA-N 354.322 2.861 50 40 FFGB O=C(COc1cccc(F)c1)NNC(=O)c1cccc(C(F)(F)F)c1 2628505 ZNBZWYYHSMRRNQ-UHFFFAOYSA-N 356.275 2.685 50 40 FFGB N#CC(C#N)=C1C(=O)N(CN2CCN(c3ccccc3)CC2)c2ccccc21 19990970 HBCSYPFTQIGCSU-UHFFFAOYSA-N 369.428 2.614 50 40 FFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1sccc1C 408906903 DZWIKGCXJJKYJI-IYSPOMMRSA-N 359.451 2.864 50 40 FFGB N#CC1=C(N)SC(N)=C(C#N)C1c1ccc(F)c(Br)c1 705846 IZSIYLSGKAKVHJ-UHFFFAOYSA-N 351.204 2.806 50 40 FFGB CCOc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])c(OC)cc2OC)cc1 20764093 HNSRMGTZFFIKOK-YBFXNURJSA-N 373.365 2.775 50 40 FFGB N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)N1CCN(c2ccccc2)CC1 13141315 QIWSERQPMRDRIW-SAPNQHFASA-N 362.389 2.851 50 40 FFGB CCOc1ccccc1/C=N/NC(=O)COc1ccc(C)cc1[N+](=O)[O-] 13847805 ARMIXEXMTRFCEJ-YBFXNURJSA-N 357.366 2.831 50 40 FFGB Cc1ccc(Cl)cc1N(CC(=O)NN=C1CCCCC1)S(C)(=O)=O 408786490 RAXFZFGXMNBLBF-UHFFFAOYSA-N 371.890 2.851 50 40 FFGB CC(=O)Nc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(F)cc2)cc1 16137080 OEHGIYPAFDVCOS-FSJBWODESA-N 370.384 2.919 50 40 FFGB O=C(N/N=C\c1ccc(N2CCOCC2)o1)c1cccc(C(F)(F)F)c1 4470545 MXDHUQOHVGOBBW-NHDPSOOVSA-N 367.327 2.899 50 40 FFGB O=C(COc1ccccc1)NNC(=O)COc1ccc(Cl)cc1Cl 3218272 IQOUVBLJWQWNFS-UHFFFAOYSA-N 369.204 2.599 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)OCC(=O)N(C)C2CCCCC2)cc1 3244080 LODPHOWIQIBNEU-FOWTUZBSSA-N 356.422 2.936 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)c2cnc(Cl)c(Cl)c2)c1 3341935 IZUDKOVVDNFHNJ-UHFFFAOYSA-N 368.220 2.845 50 40 FFGB COc1ccc2c(c1)/C(=N\NC(=O)c1cc(F)c(F)cc1Cl)C(=O)N2 59472608 USXSWMRLAOWDCC-UHFFFAOYSA-N 365.723 2.713 50 40 FFGB C#CCn1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])c2ccccc21 107590713 WERFTNHCHYKHJU-BKUYFWCQSA-N 360.373 2.876 50 40 FFGB CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)NNC(=O)c1ccccc1 103916630 UDVRGTMJCGNRSL-ATVHPVEESA-N 352.369 2.757 50 40 FFGB CCOc1ccc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1OC 409048139 QKVSIIQIBGDJIP-RGVLZGJSSA-N 356.378 2.515 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] 409057082 OUQNJXJFADHMDQ-WOJGMQOQSA-N 372.337 2.595 50 40 FFGB O[C@@H]1[C@H]2[C@H]3C[C@H]4[C@H]5[C@@H]3[C@H]1[C@@](c1ccccc1)([C@@H]5I)[C@@H]24 245264228 CDNDXHOZUAFLPN-YUGQHCDFSA-N 364.226 2.860 50 40 FFGB CC(C)(O)C(=O)N/N=C/c1cccc(OC(=O)c2ccc(Cl)cc2)c1 32578378 SNBOYPQPNKXWFR-RGVLZGJSSA-N 360.797 2.780 50 40 FFGB CCOc1ccc(COc2ccccc2-c2cc(C(=O)NN)[nH]n2)cc1 40217065 DECOXEASIPVLNC-UHFFFAOYSA-N 352.394 2.658 50 40 FFGB COc1ccc2c(c1)/C(=N\NC(=O)C13CC4CC(CC(C4)C1)C3)C(=O)N2 6647240 QWTKVDXSEJHTNV-UHFFFAOYSA-N 353.422 2.684 50 40 FFGB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/NNC(=O)Cc1ccccc1 100927545 WUCUBDXYFOMFMZ-SFQUDFHCSA-N 368.824 2.810 50 40 FFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc(C)cc3)CC2=O)cc1 6962922 JIGKMVDIRDPREB-NEIHUHTASA-N 365.433 2.897 50 40 FFGB COc1cccc(C(=O)N/N=C/c2ccc(OCC(=O)O)c(Cl)c2)c1 59679330 RXVGGZTZDPECBC-DJKKODMXSA-N 362.769 2.576 50 40 FFGB COc1ccc(C(=O)NNc2ncnc3c2cnn3-c2cccc(C)c2)cc1 4355156 ASSSGHKLUSSEFN-UHFFFAOYSA-N 374.404 2.889 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)[C@H](C)Oc1ccc(C)cc1 15893531 HRQZIOMBJAXCDI-LBPRGKRZSA-N 362.813 2.886 50 40 FFGB CCOc1cccc(/C=N\NC(=O)Nc2ccccc2)c1OCC(=O)O 409214458 XMSNNJBUROPGQV-ODLFYWEKSA-N 357.366 2.704 50 40 FFGB Cc1cccc(C)c1NC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32 408682693 GPWNQOITJRBOCC-CGNPOWQISA-N 364.239 2.813 50 40 FFGB N#C/C(=C\c1ccc(OCC(N)=O)cc1)C(=O)Nc1cccc(Cl)c1 408735310 QFDGAWUTIVGDQC-MDWZMJQESA-N 355.781 2.750 50 40 FFGB CC(C)NC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1Cl 408607464 DBEZWLROCXPIFC-SRZZPIQSSA-N 373.840 2.894 50 40 FFGB COc1cc(/C=C(\C#N)C(N)=S)cc(I)c1OC 408542461 IZQHLONJBMDUQO-FPYGCLRLSA-N 374.203 2.501 50 40 FFGB C[C@@H](NC(=O)c1ccccc1)C(=O)NNc1c(F)c(F)c(F)c(F)c1F 28335357 MAKFBUSTWZXTPN-SSDOTTSWSA-N 373.281 2.644 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1 13534903 WNTHNHKOFQASAZ-XFXZXTDPSA-N 367.430 2.890 50 40 FFGB Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1-c1cccc(C(=O)O)c1 12406528 STGAXVYWWCSPGN-WSDLNYQXSA-N 362.389 2.951 50 40 FFGB O=C(N/N=C/c1ccc(S(=O)(=O)O)o1)c1ccc(Cl)cc1Cl 18192149 OVTGTLVIHJDQDA-GIDUJCDVSA-N 363.178 2.597 50 40 FFGB CCOc1cc2c(cc1/C=N/NC(=O)c1ccc(C#N)cc1F)OCO2 408967029 OVMIUZRGNCETTN-ZVBGSRNCSA-N 355.325 2.589 50 40 FFGB COC(=O)COc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(OC)cc1 408794054 HSBQNHUFTKUIIY-RVDMUPIBSA-N 366.373 2.793 50 40 FFGB CC[C@H](Oc1ccccc1)C(=O)NNC(=O)COc1cc(C)ccc1C 6540408 PRRUVZMKIWGAHU-KRWDZBQOSA-N 356.422 2.687 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc(Cl)c1O 409043018 PDNHZLXIQCXPFJ-GIJQJNRQSA-N 363.757 2.655 50 40 FFGB Cc1cc(C)c(OCC(=O)N/N=C/c2cccnc2)c(Br)c1 5452037 RFEULSXKZDZZIF-DJKKODMXSA-N 362.227 2.990 50 40 FFGB Cc1cc2c(c(=O)o1)[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 714325 AURMXPOPZYMGQV-CYBMUJFWSA-N 359.725 2.728 50 40 FFGB O=[N+]([O-])c1ccc([C@@H]2[C@H]3C[C@H]4[C@H](OO[C@H]24)[C@@H]3I)cc1 104068050 OPAZSUHPECXLGD-PTEOKISQSA-N 373.146 2.831 50 40 FFGB C/C(=N\NC(=O)C(C)C)c1ccc(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 101638371 CINOZGMIXOEEPC-KSZYVRDXSA-N 355.438 2.862 50 40 FFGB O=C(N/N=C/c1cccc(Br)c1)C(=O)NC1CCCCCC1 409006903 SFKREJBWSXEAIU-WOJGMQOQSA-N 366.259 2.738 50 40 FFGB COc1ccc(C/C(C)=N/NC(=O)CCn2nc(C)cc2C)cc1OC 4805916 PLWNZHZBELPENJ-DEDYPNTBSA-N 358.442 2.642 50 40 FFGB C[C@@H]1CN(C(=O)NNC(=O)c2ccc(F)cc2)C[C@@H](c2ccccc2)O1 67874501 AUCXPYSMWZKHPX-DYVFJYSZSA-N 357.385 2.642 50 40 FFGB N#C/C(=C/c1cccc(OCC(N)=O)c1)C(=O)Nc1cccc(Cl)c1 409224971 MWNWYLZEMYFVIB-QPEQYQDCSA-N 355.781 2.750 50 40 FFGB CCCOc1ccc(C(=O)N/N=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)cc1 20197319 SQBUDEKONIQYSB-YBFXNURJSA-N 373.365 2.862 50 40 FFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)cc1 3071382 UQUYJNNLMIJHFC-UFFVCSGVSA-N 365.311 2.803 50 40 FFGB CCn1c(=O)c(C(=O)N/N=C/c2ccc(F)cc2)c(O)c2ccccc21 100680736 PUSLWFYWTOQBAN-SRZZPIQSSA-N 353.353 2.630 50 40 FFGB O=C(COc1cccc(F)c1)NNC(=O)c1ccc(OC(F)(F)F)cc1 2628445 HHZANOCYIGYIIN-UHFFFAOYSA-N 372.274 2.564 50 40 FFGB Cc1ccc(NCC(=O)N/N=C2\C(=O)N(C(C)C)c3ccccc32)cc1 5797312 AJVYXYDLKJJGGG-NMWGTECJSA-N 350.422 2.682 50 40 FFGB O=C(CC12CC3CC(CC(C3)C1)C2)NNS(=O)(=O)c1cccc(F)c1 7519251 ZYTJKHRWOPEVCN-UHFFFAOYSA-N 366.458 2.742 50 40 FFGB CCCNC(=O)C(=O)N/N=C/c1cccc(OCc2ccccc2Cl)c1 408608635 HYFCAYPZXIRBRU-WSDLNYQXSA-N 373.840 2.895 50 40 FFGB O=C(NCCCl)Nc1ccccc1NS(=O)(=O)c1cccs1 6147086 LLVAVJNOIMOWFL-UHFFFAOYSA-N 359.860 2.909 50 40 FFGB CCOc1ccc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)cc1OC 6595894 DUBLLEGISKMRTF-UDWIEESQSA-N 358.394 2.875 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1ccc2ccccc2n1 2664223 YJGWDCDCMDFSKO-UHFFFAOYSA-N 355.781 2.972 50 40 FFGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(N2CCOCC2)o1 408997611 SASVHWDDJAWHRS-ITRAFESCSA-N 359.451 2.747 50 40 FFGB COC(=O)COc1ccccc1/C=N/NC(=O)c1ccc(C)cc1Cl 409052427 HIPBBXYKEQUUSS-KEBDBYFISA-N 360.797 2.964 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@H]2C[C@H]2c2cccc(F)c2)c2ccccc21 67132458 ZNLWSDYZZCJIND-HOTGVXAUSA-N 351.381 2.882 50 40 FFGB COC(=O)N/N=C(C(=N/NC(=O)OC)/c1ccccc1)\c1ccccc1 5526180 MLLNXBCHEXTCDR-MXWIWYRXSA-N 354.366 2.507 50 40 FFGB C[C@]1(O)NC(S)=C(C#N)[C@H](c2ccc(Cl)cc2)[C@H]1[n+]1ccccc1 20459105 UUHKKRHAOIPVPD-LZLYRXPVSA-O 358.874 2.929 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(Br)cc2)ccc1O 4735238 XBFYXCNJQOHDNV-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB Cc1ccc(S[C@H](C)C(=O)NNC(=O)Cc2cn3ccsc3n2)cc1 9604159 IOWXGIMULTXFDX-GFCCVEGCSA-N 374.491 2.575 50 40 FFGB COc1ccc2cc(C(=O)N/N=C/c3cccc(OC)c3OC)[nH]c2c1 2241578 ZHUZJYRZODFHQW-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB Cc1nc(S)sc1CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2 17159101 FBCQQEGWLCEGBN-UHFFFAOYSA-N 365.524 2.647 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)cc2c1OCCO2 44028626 REESGCCYVKZFCY-MKMNVTDBSA-N 365.341 2.985 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc2c1OCO2 7386501 MXDRTHZZCFNFJA-CIAFOILYSA-N 367.405 2.788 50 40 FFGB CC1(C)C(=O)[C@]2(Br)CC[C@]1(CC(=O)O)[C@H]2Br 109275423 OUDQDORDQBJHEI-GGVZMXCHSA-N 354.038 2.747 50 40 FFGB N#Cc1ccc(/C=N/NC(=O)CNc2ccc(Br)cc2)cc1 409341093 CNRRNZYBWXYJEJ-KEBDBYFISA-N 357.211 2.883 50 40 FFGB CCOc1cc(/C=N/NC(=O)CCc2ccccc2)cc([N+](=O)[O-])c1O 37061929 NKCYVCFJWPDTMM-XDHOZWIPSA-N 357.366 2.782 50 40 FFGB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)NNC(=O)c1cncn1-c1ccc(F)cc1 103323555 MNPYEKOXSVGOQB-IHRRRGAJSA-N 356.401 2.599 50 40 FFGB Cn1cc(C(=O)NNC(=O)N[C@@H]2CCOc3ccccc32)c2ccccc21 45116273 XYZQZFYRLSUYFI-MRXNPFEDSA-N 364.405 2.646 50 40 FFGB COCCn1c(C)cc2c(c1=O)[C@@H](c1ccccc1Cl)C(C#N)=C(N)O2 2354327 UYXZRNOCJHNWCU-INIZCTEOSA-N 371.824 2.675 50 40 FFGB Cc1cc(C)cc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)C)c2C)c1 4703173 GUMOSTFIRZPJNV-SRZZPIQSSA-N 354.454 2.686 50 40 FFGB Cc1cc(O[C@H](C)C(=O)N/N=C2\N=C(N)c3ccccc32)cc(C)c1Cl 16269388 JSRLSXJEFZUNEK-GFCCVEGCSA-N 370.840 2.921 50 40 FFGB NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNc3cccc(Cl)c3)cc2)C1 53324259 AEMJDMTUUAGVNP-CQSZACIVSA-N 372.856 2.799 50 40 FFGB O=C(N/N=C/c1cccc(Br)c1)[C@H]1COc2ccccc2O1 783313 GTJAWIIQCKTBFQ-QANDDYDISA-N 361.195 2.739 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(C)cc2C)c1C 58913964 JAVDGQFMOHJZHO-QRVIBDJDSA-N 366.465 2.853 50 40 FFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2ccc3c(c2)OCO3)cc1 5634367 ZGRMZQOZCLHNCN-FBHDLOMBSA-N 364.361 2.578 50 40 FFGB CN(C)c1ncccc1C(=O)NNC(=O)c1cc2c(s1)CCCCC2 83852406 UCVZJDPHTXDKQM-UHFFFAOYSA-N 358.467 2.553 50 40 FFGB C/C(=N\NC(=O)NC[C@@H]1CCCO1)c1sc2nc(C)nc(C)c2c1C 84066823 WEODHSKKKWNGHX-PUFAJPFRSA-N 361.471 2.819 50 40 FFGB CCOC(=O)COc1cc(/C=N\NC(=O)c2ccc(C)cc2)ccc1OC 409216396 HUKFSBBETCWIGI-MTJSOVHGSA-N 370.405 2.709 50 40 FFGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccc(N(C)C)o1 408996351 DDURCQYRBCIWLK-RQZCQDPDSA-N 366.215 2.881 50 40 FFGB O=C(/C=C/c1c(C2CC2)sc2cncn12)NNC(=O)c1ccccc1 1616033396 OIYAQYOLIURDDA-CMDGGOBGSA-N 352.419 2.748 50 40 FFGB COC(=O)c1ccc(N/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)cc1 11692031 GCZOTFCPMVPKRL-WYMLVPIESA-N 351.362 2.940 50 40 FFGB Cc1noc(C)c1COc1ccccc1C(=O)NNC(=O)c1ccccc1 12980942 FOMGJJLEGVOLKC-UHFFFAOYSA-N 365.389 2.945 50 40 FFGB CCOC(=O)/C(C#N)=C\c1cn(CCC(=O)O)nc1-c1ccc(OC)cc1 6179697 FCWHIELKFUQLGG-UVTDQMKNSA-N 369.377 2.503 50 40 FFGB O=C(N/N=C/c1cc2cc3c(cc2nc1Cl)OCCO3)c1cccnc1 32608384 GPDAMYHEZAZLPI-UFFVCSGVSA-N 368.780 2.818 50 40 FFGB CCN(CC)C(=O)CSC1=C(C#N)[C@@H](c2ccc(OC)cc2)CC(=O)N1 6325202 JNBDCVDQKMGHGB-OAHLLOKOSA-N 373.478 2.635 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1ccccc1-n1cccc1 6644113 VAUVLDSXTDGMJF-UHFFFAOYSA-N 350.447 2.786 50 40 FFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)cc1 59515465 HUXGHRFCDNNWAG-LPYMAVHISA-N 353.422 2.585 50 40 FFGB O=C(N/N=C/c1cc(O)ccc1Br)c1ccccc1[N+](=O)[O-] 4603631 JARQBYLTNNSBHR-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CN1/C(=C(/C#N)C(=O)COC(=O)c2cccn2C)Sc2ccccc21 96809715 SZWBYTDAUAMJDF-SFQUDFHCSA-N 353.403 2.728 50 40 FFGB O=C(N/N=C1\C(=O)N(CN2CCCCCC2)c2ccccc21)c1ccco1 20025619 PNJSYXSDIIUSPG-UZYVYHOESA-N 366.421 2.594 50 40 FFGB O=C(/C=C/c1cccs1)NNC(=O)c1ccc(NC(=O)C2CC2)cc1 1298158 DHWNAALKUSELJU-MDZDMXLPSA-N 355.419 2.571 50 40 FFGB C/C(CC(=O)Nc1ccc([N+](=O)[O-])cc1)=N/NC(=O)C1[C@H]2CCCC[C@@H]12 17950762 IVOGQQSWWHBBJF-PPSAEABQSA-N 358.398 2.852 50 40 FFGB C/C(N)=C(/C#N)C(=O)COC(=O)c1cc2c(s1)-c1ccccc1OC2 4491941 SSYAZVMTYVZHRT-JLHYYAGUSA-N 354.387 2.790 50 40 FFGB COc1cc(C(=O)NN)cc(Br)c1OCc1ccc(F)cc1 226365155 PHYPARYPRWCAML-UHFFFAOYSA-N 369.190 2.779 50 40 FFGB COc1ccc(CC(=O)N/N=C\c2cc(Br)ccc2O)cc1 32561698 NMVFFSWSVIOIMR-ZDLGFXPLSA-N 363.211 2.856 50 40 FFGB O=C(NNC(=O)C(F)(F)F)c1ccc(NC(=O)C2CCCCC2)cc1 955310 KKWFJLPVQYUISF-UHFFFAOYSA-N 357.332 2.529 50 40 FFGB CC(C)(C)C(=O)N1CCC(=NNC(=O)Cc2c[nH]c3ccccc23)CC1 54871275 IYUHLPBCEYSWCB-UHFFFAOYSA-N 354.454 2.851 50 40 FFGB CCOc1ccc(S(=O)(=O)NNC(=O)c2cc(C)c(CC)s2)cc1 7387137 XDOMXWHFLLIYNE-UHFFFAOYSA-N 368.480 2.641 50 40 FFGB CC[C@@H](Br)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 61487926 RSLGQRKMKXCTMT-GFCCVEGCSA-N 352.232 2.596 50 40 FFGB O=C(N/N=C/c1ccc(Br)cc1)C(=O)NC1CCCCCC1 409007602 YFCKMRJGGXXMDQ-WOJGMQOQSA-N 366.259 2.738 50 40 FFGB COc1cc2c(cc1OC)C(NNC(=O)c1ccccc1)=NC(C)(C)C2 5415288 LJQUZBXFGZDXPY-UHFFFAOYSA-N 353.422 2.720 50 40 FFGB C/C(=N\NC(=O)CNC(=O)c1ccccc1Br)c1ccccc1 15133454 IHZIOZXMKSPSKO-UDWIEESQSA-N 374.238 2.719 50 40 FFGB CCOc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1OC 6964076 PVIGXNZGLRSTHI-VXLYETTFSA-N 374.466 2.743 50 40 FFGB O=C(NNc1ccccc1[N+](=O)[O-])C1(c2cccc(F)c2)CCOCC1 57180175 WGCKVVSGXOHHRM-UHFFFAOYSA-N 359.357 2.925 50 40 FFGB CCCC1=NN(c2ccccc2)C(=O)/C1=C(/C)NNC(=O)c1ccncc1 103918427 PQFZORFJFSMPSJ-JXAWBTAJSA-N 363.421 2.793 50 40 FFGB O=C(N/N=C/c1cccnc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 59444735 FTLXZMPLXDZJKY-OEAKJJBVSA-N 374.400 2.749 50 40 FFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCCOc1ccc(C)cc1 4196595 BHUVSWHCFMIPMW-FYJGNVAPSA-N 357.410 2.854 50 40 FFGB Cc1nn(C[C@H](C)C(=O)NC2=C(C#N)CCC2)c(C)c1Br 6526432 ZJGJURPZHYIXCW-VIFPVBQESA-N 351.248 2.976 50 40 FFGB O=C(CN1CCCc2ccccc21)NNC(=O)NC1CCCCCCC1 95949749 HMIRGVZOSJYCAL-UHFFFAOYSA-N 358.486 2.883 50 40 FFGB CCCCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1 408613402 ZNMNBTIIOHMPRC-HYARGMPZSA-N 353.422 2.632 50 40 FFGB O=C(NCc1ccccc1)C(=O)N/N=C/c1ccc(Cl)cc1Cl 5603229 MOPCLFIHQBMNSR-KEBDBYFISA-N 350.205 2.760 50 40 FFGB NNC(=O)c1cc(Br)ccc1-c1cc2ccccc2oc1=O 226357508 QISOKJSKNLVDCR-UHFFFAOYSA-N 359.179 2.826 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)c1 653848 PHCIXPKZLSSAGX-KEBDBYFISA-N 352.394 2.732 50 40 FFGB CCOc1ccc(N[C@H](C)C(=O)N/N=C/c2ccc(O)c(OC)c2)cc1 695567 MJUNAHFLQRZUTD-HMHKGCENSA-N 357.410 2.750 50 40 FFGB O=C(NNC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1ccco1 12544133 IBTYMYLOKKZNLO-UHFFFAOYSA-N 358.357 2.965 50 40 FFGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=CCC[C@H]2[C@H]1c1ccc(OC)cc1 20470027 RJCZKWNAUSKZQS-BLIXFSHQSA-N 363.417 2.938 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)ccc1O 5489110 YARHMPKVECVOLX-VXLYETTFSA-N 354.366 2.846 50 40 FFGB O=C(N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21)c1cccnc1 6530369 QHCJRBBENFDTEL-NMWGTECJSA-N 356.385 2.763 50 40 FFGB N#C/C(=C\c1ccc(Cl)c(Cl)c1)C(=O)NCCCN1CCOCC1 15230287 IDUGLMBGUSDHGE-GXDHUFHOSA-N 368.264 2.739 50 40 FFGB COc1ccc(OC)c(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c1 408712643 DOOJMGJCVWFOBG-UHFFFAOYSA-N 370.796 2.789 50 40 FFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCCC1)c1cccc(F)c1 409127373 HIENCPKBMYKBOS-UHFFFAOYSA-N 369.462 2.808 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)cc([N+](=O)[O-])c1O 34772547 IXNKRDQYIMMDIM-VGOFMYFVSA-N 353.334 2.532 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)cc1 3067340 GLEDRPIFYDFKGI-KEBDBYFISA-N 373.796 2.524 50 40 FFGB COc1ccccc1/C=N/NC(=O)c1cc2c(OC)c(OC)ccc2[nH]1 2210676 FHIWSXDTCZRZAR-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB N#C/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)N1CCOCC1 858289 NQTBYWMUDKAJNJ-KAMYIIQDSA-N 353.334 2.621 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)ccc1O[C@H](C)C(=O)O 23382904 PDPYGSNCQMAQDU-QQFZQELXSA-N 372.421 2.903 50 40 FFGB COc1ccccc1C(=O)NNC(=O)COc1ccc(Cl)cc1Cl 832002 QYEPHSLEEDUCGB-UHFFFAOYSA-N 369.204 2.842 50 40 FFGB CCCCOc1ccccc1C(=O)NNC(=S)NC(=O)CCCC 4977083 OANCIWGOEQVWEM-UHFFFAOYSA-N 351.472 2.691 50 40 FFGB Cc1cc2c(c(=O)n1C)[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 2351226 LROFIWMHLPPMOM-AWEZNQCLSA-N 372.222 2.674 50 40 FFGB C=CCc1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc(OC)c1O 108150780 LQJSMSZGHQWXTR-NDENLUEZSA-N 369.377 2.730 50 40 FFGB CCOc1ccccc1[C@H]1C(C(=O)OC)=C(C)N=C2SC(C#N)=C(N)N21 408604465 JOWWDNGGFYQQBG-HNNXBMFYSA-N 370.434 2.643 50 40 FFGB Cc1cc(/C=N\NC(=O)c2ccco2)c(C)n1NC(=O)c1ccccc1 8334710 HGXAMEPMCHQNGD-NDENLUEZSA-N 350.378 2.846 50 40 FFGB O=C(O)[C@H](Br)[C@H](Br)c1ccc([N+](=O)[O-])cc1 1737471 FZSNEPIHJADWSK-HTQZYQBOSA-N 352.966 2.879 50 40 FFGB in-vitro COc1cc(/C=N/NC(=O)c2ccncc2)ccc1OC(=O)c1ccco1 1424990 UHZPDADBHNPYMW-CIAFOILYSA-N 365.345 2.666 50 40 FFGB Cc1ccc(/C=C(\C#N)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)o1 2324808 GKZOLCVXSMRYGM-RVDMUPIBSA-N 362.389 2.932 50 40 FFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2OCC)CC(=O)N1 9110468 WBIDNASKOGZPEU-CYBMUJFWSA-N 360.435 2.720 50 40 FFGB COC(=O)c1ccc(C(=O)[C@H](Br)CBr)cc1 309350498 DADFXODQEKSILO-SECBINFHSA-N 350.006 2.814 50 40 FFGB O=C(N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1)c1cc([N+](=O)[O-])ccc1O 28615367 AGWGUKVCGVXXEA-APSNUPSMSA-N 364.701 2.626 50 40 FFGB Cc1ccc(C)c(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)c1 102612221 ISDLBGMHZQLDRI-BFUSDRCBSA-N 364.239 2.813 50 40 FFGB Cc1cc(OCC(=O)NNC(=O)COc2ccccc2C)ccc1Cl 1801252 KTCPQVQDVRCMKP-UHFFFAOYSA-N 362.813 2.562 50 40 FFGB CN(NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(N)=O 95456390 POFDMUYUEIGBQE-UHFFFAOYSA-N 354.288 2.548 50 40 FFGB CCc1ccc(S(=O)(=O)NNC(=O)c2oc3ccccc3c2C)cc1 8109787 JFNPMUBQARTZRJ-UHFFFAOYSA-N 358.419 2.927 50 40 FFGB C[C@H](SCc1ccccc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 40140073 WDSJHIWFRZQKBP-LBPRGKRZSA-N 359.407 2.678 50 40 FFGB C=CCc1ccccc1OCC(=O)N/N=C/c1cc(OC)ccc1OC 3174402 XEISNNICKIZXNQ-FYJGNVAPSA-N 354.406 2.961 50 40 FFGB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)NNC(=O)c1sccc1C)[C@H]2C(=O)O 5756412 FCUZTBBHXJMZQL-UNJBNNCHSA-N 362.451 2.511 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc1Br 704725 LCCNQLQEPKMXOP-VIZOYTHASA-N 368.143 2.723 50 40 FFGB O=C(NCc1ccccc1)C(=O)N/N=C/c1ccc(Cl)c(Cl)c1 59459572 VQCWTCSPMJSHBT-KEBDBYFISA-N 350.205 2.760 50 40 FFGB CNC(=O)/C(C#N)=C/c1ccc(OC)c(Oc2nc(Cl)ncc2F)c1 409007778 QTYZJMDRTFIFFA-BJMVGYQFSA-N 362.748 2.723 50 40 FFGB O=C(N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)Nc1ccccc1 409006040 HDTHGMMEVLBCKZ-UYRXBGFRSA-N 369.381 2.587 50 40 FFGB COc1ccc(OCC(=O)N/N=C(/CCC(=O)O)c2cccs2)cc1 6736596 MQVVRKGQFCHGHE-JXAWBTAJSA-N 362.407 2.521 50 40 FFGB CCOc1cc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)ccc1OC 409366823 YWVVKZINODPEPG-BKUYFWCQSA-N 370.405 2.558 50 40 FFGB O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)[C@@H]1CCCO1 72009424 SKERKCBMOPMQLZ-IPYPFGDCSA-N 371.462 2.673 50 40 FFGB COc1cc(/C=N/NC(=O)CC(=O)Nc2cccc(Cl)c2)ccc1O 1437728 PLIVFEGBAPQPJB-VXLYETTFSA-N 361.785 2.533 50 40 FFGB CCOc1ccc(-c2nc(CC(=O)NNC(=O)c3ccco3)cs2)cc1 32779763 XBHZEMXPHAJFHW-UHFFFAOYSA-N 371.418 2.806 50 40 FFGB O=C(COc1ccc2cc(Br)ccc2c1)NNc1ncccn1 52410150 AXWHIJIXNFLHAF-UHFFFAOYSA-N 373.210 2.914 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C/c2cn(CC#N)c3ccccc23)c1 107646056 MQUQDRRTWFKJOX-WSDLNYQXSA-N 362.389 2.946 50 40 FFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)cc1 408909520 UUOSOVOWTHOJKD-SXZORUHJSA-N 369.421 2.503 50 40 FFGB O=C(CN1C[C@H](c2ccccc2)CC1=O)N/N=C/c1ccccc1Cl 408973988 SVCXRHCPOPPRQH-BTZNOAQDSA-N 355.825 2.806 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1 408730605 RTWQGNHUFQHTMQ-VXLYETTFSA-N 358.419 2.777 50 40 FFGB Cc1ccc(C)c(OCC(=O)n2c(C)c(C(=O)NN)c3ccccc32)c1 218737037 AGJDTKNZEARWGT-UHFFFAOYSA-N 351.406 2.889 50 40 FFGB COc1ccc(CC(=O)NNC(=O)c2cc3cc(Cl)ccc3n2C)cc1 199414756 CMPLPZOMXYIIEQ-UHFFFAOYSA-N 371.824 2.844 50 40 FFGB CC(C)(C)c1ccc(/C=N/NC(=O)Cn2nnc(-c3ccccc3)n2)cc1 1106605 INHYBGFVLDBSEN-FYJGNVAPSA-N 362.437 2.788 50 40 FFGB N#CC1=C(SCC(=O)N2CCCC2)NC(=O)C[C@@H]1c1ccc(F)cc1 6495437 AZDDTGAPWBYOAY-CQSZACIVSA-N 359.426 2.520 50 40 FFGB C[C@@H]1Oc2ccccc2C=C1/C=N/NC(=O)[C@@H](C)NC(=O)OC(C)(C)C 2437847 MVRQREBAXNWAMR-REDRSDJCSA-N 359.426 2.866 50 40 FFGB O=C(OCCl)O[C@@H]1c2nccnc2C(=O)N1c1ccc(Cl)cn1 22054720 LTLOOQRIMYDJAP-GFCCVEGCSA-N 355.137 2.534 50 40 FFGB in-vitro CCN(CC)c1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)c(O)c1 3527171 JXNQIWOHLPGYPI-CIPMJJFUSA-N 369.421 2.529 50 40 FFGB C=CCn1c(SCC(=O)/C(C#N)=C(/C)N)nc2sc(CC)cc2c1=O 6498556 PRVQJXWGJYRSNF-RAXLEYEMSA-N 374.491 2.624 50 40 FFGB CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3cc(C)n[nH]3)o2)cc1 4953514 TUGLUWNPNNJXPE-RGVLZGJSSA-N 366.377 2.919 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1cccn1-c1ccccc1 408857113 KXKDWRLOYXQNBB-MOSHPQCFSA-N 364.361 2.915 50 40 FFGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C\c1ccccc1[N+](=O)[O-] 32125479 LLPMZNLSWPVVIC-LSCVHKIXSA-N 357.757 2.968 50 40 FFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)=C(c3cccs3)[C@H]2C1 4354136 NTERRWNXTAYODR-AWEZNQCLSA-N 352.419 2.790 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)c1cccc(N(C)C)c1 14094839 KPGYBEFZRBQTIU-UHFFFAOYSA-N 361.829 2.554 50 40 FFGB CCOC(=O)c1c(NC(C)=O)sc2c1CC[C@H](Br)C2=O 4696808 CDCGUOVAAKPRKR-QMMMGPOBSA-N 360.229 2.776 50 40 FFGB CC(C)(C)OC(=O)N1CC[C@@H]2O[C@@H](CI)C[C@H]2C1 91302747 AQIMUCSSHUZPPS-AXFHLTTASA-N 367.227 2.836 50 40 FFGB CC(=O)NNC(=O)Cc1c(C)nn(-c2ccc(Cl)c(Cl)c2)c1C 58832273 NNWVLDLIZMNRAZ-UHFFFAOYSA-N 355.225 2.506 50 40 FFGB O=C(NNC(=O)C1CCOCC1)c1sc2cc(F)ccc2c1Cl 30888557 PDHKEXRKIWELDD-UHFFFAOYSA-N 356.806 2.881 50 40 FFGB Cc1ccc(NC(=O)NCCCl)cc1S(=O)(=O)N1CCCCC1 4935011 MOYFXGSVVPHEFV-UHFFFAOYSA-N 359.879 2.530 50 40 FFGB COc1ccc2[nH]c(C(=O)N/N=C/c3cccc(OC)c3OC)cc2c1 2230369 DQBPTEIGBDEFOE-RGVLZGJSSA-N 353.378 2.958 50 40 FFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 12807402 WCIYVOGYJXLVRN-QGZVFWFLSA-N 354.406 2.585 50 40 FFGB Cc1c(C(=O)NNC(=O)CC2(C(=O)O)CCCCC2)oc2ccccc12 14244900 QXJVDOKZIVFAFD-UHFFFAOYSA-N 358.394 2.927 50 40 FFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)Cc1ccc(Cl)cc1 409371418 FLZPVCMZQMXORV-UDWIEESQSA-N 371.780 2.953 50 40 FFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CSCc1ccccc1 8239172 ADANFDCHMOTHHT-CYBMUJFWSA-N 362.426 2.674 50 40 FFGB Cc1c(C(=O)NNC(=O)CCc2ccc3c(c2)OCO3)oc2ccccc12 8920042 AUSQPICFONCQNT-UHFFFAOYSA-N 366.373 2.864 50 40 FFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)c1cc(Br)ccc1O 5520552 OEWRPFFICFTYQN-UHFFFAOYSA-N 374.194 2.549 50 40 FFGB CC(=O)Nc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)cc1 8565997 HOVPDDZRQRTFMZ-AWEZNQCLSA-N 351.410 2.884 50 40 FFGB CCCCOc1ccc(/C=N/NC(=O)C(=O)NCc2ccccc2)cc1 59505943 VZPQXLHDXCFPRC-PXLXIMEGSA-N 353.422 2.632 50 40 FFGB O=C(NNC(=O)C1CC1)c1oc2ccccc2c1CSc1ncccn1 58434201 IQIOALZQVQIYGS-UHFFFAOYSA-N 368.418 2.686 50 40 FFGB CCCc1ccc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)cc1 14197235 HBNIAUDUVVBNQO-UHFFFAOYSA-N 357.435 2.744 50 40 FFGB O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(Cl)cc1 5569508 UQFFDOIHMAYDFF-UHFFFAOYSA-N 354.149 2.976 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@H]1c1cccc([N+](=O)[O-])c1 4742399 SQYIEWGQPYEFJA-HNNXBMFYSA-N 373.324 2.736 50 40 FFGB C/C(=N\NC(=O)c1nc2ccccn2c1C)c1ccc(-n2ccnc2)cc1 4863941 RYQGHRUVWOZIHR-OEAKJJBVSA-N 358.405 2.982 50 40 FFGB COCc1n[nH]c2c1[C@@H](c1ccccc1C(F)(F)F)C(C#N)=C(N)O2 809409 ZGSRJNRWLBRQLK-LBPRGKRZSA-N 350.300 2.793 50 40 FFGB N#CC(C#N)=C(NCc1ccc(Cl)nc1)NCc1ccc(Cl)cn1 1087416 XTTNSMGCTXABGW-UHFFFAOYSA-N 359.220 2.922 50 40 FFGB O=C(N/N=C/c1cc(Br)c(N2CCCC2)o1)c1cccnc1 59678872 VANIKCVUHSYCLX-VCHYOVAHSA-N 363.215 2.801 50 40 FFGB CCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccc(Cl)cc2)s1 59498728 FCXNWQBLZVAKCV-RQZCQDPDSA-N 365.846 2.623 50 40 FFGB N#CC1=C(N)N(c2nc[nH]n2)C2=C(C(=O)CCC2)[C@H]1c1cccc(Cl)c1 5447825 ZFYCAXDCKHUFBQ-HNNXBMFYSA-N 366.812 2.763 50 40 FFGB N#C/C(=C\c1cccc(OCCC(=O)O)c1)c1nnc2n1CCCCC2 96298141 BCJBNJNMQDADJK-RVDMUPIBSA-N 352.394 2.922 50 40 FFGB CC(C)(C)OC(=O)N1CCC2(CC1)C(C#N)=C(N)OC1=C2C(=O)CCC1 808868 ZCHKTUXIGGEWFM-UHFFFAOYSA-N 359.426 2.735 50 40 FFGB CCCCCOc1ccc(/C=C(\C#N)C(=O)NCCN2CCOCC2)cc1 27019306 XJPLZSCOHZHIDW-KNTRCKAVSA-N 371.481 2.611 50 40 FFGB Cc1cc(O[C@@H](C)C(=O)N/N=C2\N=C(N)c3ccccc32)cc(C)c1Cl 16269391 JSRLSXJEFZUNEK-LBPRGKRZSA-N 370.840 2.921 50 40 FFGB O=C(NNC(=O)c1cc(Br)ccc1F)c1ccccc1F 8274474 MJBBGCRDUQEPGO-UHFFFAOYSA-N 355.138 2.802 50 40 FFGB C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@]3(C(=O)Nc4ccccc43)[C@@H]2C1 13510014 SLCAPPSOGCMOQX-LSWYUMSHSA-N 355.401 2.633 50 40 FFGB COc1cc(C(=O)N/N=C(\C)c2ccc3c(c2)OCO3)cc(OC)c1OC 5480056 RWKXANNTBZATFP-RGVLZGJSSA-N 372.377 2.595 50 40 FFGB COC(=O)C(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1ccccc1 36559251 XBKSHKYODKRLSU-MRXNPFEDSA-N 360.369 2.648 50 40 FFGB COc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)cc1 105992709 QTILHRRSVQDYQP-WSDLNYQXSA-N 359.385 2.959 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2ccc(OCc3cccnc3)cc2)c(C)o1 24556777 FFZGPBRSQXMMBH-UHFFFAOYSA-N 365.389 2.945 50 40 FFGB C#CCOc1c(Cl)cc(/C=N\NC(=O)c2ccncc2)cc1OCC 408871403 ZLBHWMHNCMCQOC-MTJSOVHGSA-N 357.797 2.910 50 40 FFGB CC(=O)NNc1nc(C)c(C(=O)/C=C\c2ccc(NC(C)=O)cc2)s1 5808922 KYHRNORUBPIMGG-TWGQIWQCSA-N 358.423 2.769 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)CCC(=O)Nc2ccccc2C)c1 3117336 JNLDXBWEXFCNPR-FYJGNVAPSA-N 369.421 2.881 50 40 FFGB N#C/C(=C\c1ccc(-c2ccc(Br)cc2)o1)C(=O)NCCO 4032030 LQNZLJLYYNLPHP-FMIVXFBMSA-N 361.195 2.725 50 40 FFGB COc1ccc(NCC(=O)NNC(=O)c2csc3c2CC[C@H](C)C3)cc1 12543018 IYRJREIPBCSFEI-LBPRGKRZSA-N 373.478 2.755 50 40 FFGB CCOc1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1OCC 59472940 GKOIJGSNVQGEJK-MRUVXERFSA-N 370.405 2.774 50 40 FFGB COc1ccc([C@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)cc1 12275721 QDPNVWXVENURPF-AUUYWEPGSA-N 368.414 2.931 50 40 FFGB O=C(Cc1cn2ccsc2n1)NNC(=O)[C@H]1C[C@@H]1c1ccccc1Cl 9337155 MDRJMFGIQHUJAE-OLZOCXBDSA-N 374.853 2.543 50 40 FFGB CCCCC(=O)NN/C(CC)=C1\C(=O)N(C2CCCCC2)C(=O)N=C1O 9331837 MMWUXWZVFVKKNO-SQFISAMPSA-N 364.446 2.713 50 40 FFGB Cc1ccccc1NCC(=O)N/N=C/c1c(C)nn(-c2ccccc2)c1O 5705544 VBKHWDVDMXFTBI-WSDLNYQXSA-N 363.421 2.757 50 40 FFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCCC3)c2C)c1 408970863 LJFXSSVQEDTQOU-HYARGMPZSA-N 366.465 2.865 50 40 FFGB CC1CCN(S(=O)(=O)c2cccc(C(=O)CBr)c2)CC1 40163756 AQOYXZGJEMRPQV-UHFFFAOYSA-N 360.273 2.685 50 40 FFGB CCc1cccc2c(/C=N/NC(=O)c3n[nH]c(=O)c4ccccc34)c[nH]c12 5272515 CSQXGSDYGBDJMC-SSDVNMTOSA-N 359.389 2.731 50 40 FFGB O=C(CCC(=O)NNC(=O)Nc1ccc(Cl)cc1)NCc1ccccc1 4523993 NZRSVCQOKMMCOJ-UHFFFAOYSA-N 374.828 2.589 50 40 FFGB Cn1cc(C(=O)NNC(=O)[C@H]2C[C@@H]2c2cccc(F)c2)c2ccccc21 67132456 ZNLWSDYZZCJIND-CVEARBPZSA-N 351.381 2.882 50 40 FFGB COc1cc(NC(=O)NNC(=O)Nc2cccnc2)c(OC)cc1Cl 83919862 GHPTXRHQFVDENY-UHFFFAOYSA-N 365.777 2.610 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1cccnc1 4180431 UNXGKQQWJDKKQT-DEDYPNTBSA-N 353.382 2.744 50 40 FFGB CC(=O)NCCSSCCCCSSCCNC(C)=O 5459896 UHGRTXVVIBRBEL-UHFFFAOYSA-N 356.604 2.802 50 40 FFGB C/C(=N\NC(=O)COc1ccccc1F)c1ccc(N2CCOCC2)cc1 5164465 CVJNZSDSKVQMDR-PXLXIMEGSA-N 371.412 2.582 50 40 FFGB O=C(CCc1c[nH]c2ccccc12)NNC(=O)c1cc(-c2ccccc2)n[nH]1 9882995 OLLHFKPIOCCEED-UHFFFAOYSA-N 373.416 2.952 50 40 FFGB COc1cccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1 409156380 OCHBZEAVKYRFAX-QQZPLFJDSA-N 365.433 2.815 50 40 FFGB COC(=O)COc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)c1 408832490 QWQZTLMNUQDJPM-PVGUKEHMSA-N 372.446 2.869 50 40 FFGB O=C(N/N=C/c1ccccc1O)C1CCN(C(=O)c2ccc(F)cc2)CC1 409006924 SPNDFVSRGNZIMQ-LPYMAVHISA-N 369.396 2.534 50 40 FFGB COc1c(Br)cc(/C=C(/C#N)C(=O)NC(C)C)cc1[N+](=O)[O-] 408782051 FPKQINVNWXFUEZ-WMZJFQQLSA-N 368.187 2.797 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)ccc1OCC(=O)O 408979832 SQBSVRGBKLUZCZ-OVCLIPMQSA-N 369.377 2.609 50 40 FFGB CNC(=O)/C(C#N)=C\c1ccc(Oc2nc(Cl)ncc2F)c(OC)c1 16189267 NJCWLCRWSZEKDD-YHYXMXQVSA-N 362.748 2.723 50 40 FFGB CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2oc3ccccc3c2C)c1C 21782995 YJQIOFNVUUISAO-UHFFFAOYSA-N 353.378 2.964 50 40 FFGB COc1ccc(NCC(=O)NNC(=O)c2csc3c2CC[C@@H](C)C3)cc1 12543019 IYRJREIPBCSFEI-GFCCVEGCSA-N 373.478 2.755 50 40 FFGB COC(=O)[C@]12CC[C@](CBr)(C(=O)[C@H]1Br)C2(C)C 8236653 PVYFESIMHVMBHV-MKCWBWRRSA-N 368.065 2.693 50 40 FFGB COc1ccc(-n2nc3c(c2NC(=O)CBr)CSC3)cc1 4223293 RBCKDHPIFNNJSY-UHFFFAOYSA-N 368.256 2.961 50 40 FFGB CCCOc1ccc(/C=C/C(=O)OCC(=O)/C(C#N)=C(/C)N)cc1OCC 104852636 AKABREWHMXQCHR-KWVYUSMRSA-N 372.421 2.756 50 40 FFGB CC(C)CCOc1cccc(OCC(=O)NNC(=O)c2ccccc2)c1 3191408 VKDNAARYEGVJIL-UHFFFAOYSA-N 356.422 2.952 50 40 FFGB Nc1ccc(C(=O)NN2C(=O)[C@H](Cl)[C@@H]2c2ccccc2Cl)cc1 1633095 UREJEGPGLHQRMX-KGLIPLIRSA-N 350.205 2.758 50 40 FFGB CC(C)Oc1ccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccccc2)cc1 8719714 QBNLXYJFBHGHKP-UHFFFAOYSA-N 364.405 2.939 50 40 FFGB Cc1ncc(CO)c(/C=N/NC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1O 3455574 WHUZXTLITWMKSL-AUXCUJNGSA-N 359.451 2.538 50 40 FFGB COc1ccc(C(=O)Oc2ccc(/C=C(\C#N)C(=O)O)cc2OC)cc1 7155466 RSNHDOZPAKTUOQ-NTEUORMPSA-N 353.330 2.915 50 40 FFGB CC(=O)c1c(NNC(=O)CNc2cccc(Cl)c2C)oc(C)cc1=O 8048448 WPKQKUYVMFEKEF-UHFFFAOYSA-N 363.801 2.668 50 40 FFGB C[C@H]1CCc2sc(C(=O)NNC(=O)c3ccc4c(c3)COC4)cc2C1 95957201 NJXKQHCCTBNLBQ-NSHDSACASA-N 356.447 2.978 50 40 FFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(SC)cc1 408604349 IFZVZPWBKJPKOA-CQSZACIVSA-N 372.475 2.966 50 40 FFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)CC3(C)OCCO3)c2C)cc1 408587476 GHFHLQDKFLLWLN-FYJGNVAPSA-N 371.437 2.706 50 40 FFGB N#Cc1ccc(C(=O)N/N=C/c2cc(Cl)cc([N+](=O)[O-])c2O)c(F)c1 408967698 RTIOTURUQZWOCR-FBCYGCLPSA-N 362.704 2.728 50 40 FFGB N#C/C(=C/c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc([N+](=O)[O-])cc1O 6528500 UGBXJSURONQBMN-XFFZJAGNSA-N 354.278 2.754 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)N2CCCC2)c(C)n1-c1ccccc1Cl 58912483 DNDRHCDYJNNQMO-CIAFOILYSA-N 372.856 2.820 50 40 FFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)c1ccccc1OC 100922356 ZFPIAGBRHFLCJF-FYJGNVAPSA-N 355.394 2.838 50 40 FFGB O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=S)NC(=O)c1ccccc1 4791428 NOHFZJUAQSOMJO-UHFFFAOYSA-N 371.506 2.929 50 40 FFGB C[C@@H](C(=O)NN=C1CCCCCC1)N(c1ccccc1)S(C)(=O)=O 408923191 GDHIQYMSBUJNLK-AWEZNQCLSA-N 351.472 2.668 50 40 FFGB COC(=O)/C(C#N)=C/c1cccc(OC(=O)c2ccc([N+](=O)[O-])cc2)c1 1791084 DHRFKIVPWOEYSX-NTEUORMPSA-N 352.302 2.894 50 40 FFGB COc1ccccc1Nc1ncccc1C(=O)NNC(=O)c1ccco1 12589347 HRMXOBSVIPBKTD-UHFFFAOYSA-N 352.350 2.502 50 40 FFGB O=C(N/N=C/c1ccncc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 59444736 FTLFDGCJBQWFSQ-OEAKJJBVSA-N 374.400 2.749 50 40 FFGB C/C(=N\NC(=O)c1csc2ccccc12)c1ccccc1OCC(N)=O 5517029 WRWLCRBCRWPBAH-CIAFOILYSA-N 367.430 2.919 50 40 FFGB NNC(=O)CNC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 408973336 YNKHEBURXIRZLQ-UHFFFAOYSA-N 352.630 2.581 50 40 FFGB Cc1ccc(C)c(OCC(=O)NNC(=O)CCCOc2ccccc2)c1 6839670 XYQJDEJLRIEXLW-UHFFFAOYSA-N 356.422 2.689 50 40 FFGB C[C@H]1S/C(=C(/C#N)C(=O)NCc2ccco2)N(c2ccc(F)cc2)C1=O 12579977 AUJJDEKTEYLISW-FOTIKMNESA-N 371.393 2.939 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@H]2C=CC[C@@H]12)N/N=C1/C[C@H]2C=CC[C@H]12 39345217 GIRIUIXSQOYDQJ-DTZCBAOLSA-N 354.454 2.683 50 40 FFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/NNC(=O)Cc1ccccc1 100927554 FMUXDBKUKJRFPF-SFQUDFHCSA-N 368.824 2.810 50 40 FFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1c[nH]c2ccccc12 850935 ABDLGIQIAHNSAY-UFFVCSGVSA-N 353.378 2.958 50 40 FFGB Cc1ccc(O)c(C(=O)OCC(=O)/C(C#N)=C2/Nc3ccccc3N2C)c1 105074183 ZHCPWRRUYBPUDJ-RGEXLXHISA-N 363.373 2.724 50 40 FFGB O=C(NCCc1ccccc1)C(=O)N/N=C/c1ccc(Cl)cc1Cl 3062127 BNNYCTLFXZWKCE-SRZZPIQSSA-N 364.232 2.802 50 40 FFGB CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)cc1 1092803 IFUAAOVJKBMHIY-MRXNPFEDSA-N 353.426 2.620 50 40 FFGB O=C1CCSc2ccc(C(=O)NNC(=S)Nc3ccccc3)cc2N1 12522114 JASLCYKDDHTWOE-UHFFFAOYSA-N 372.475 2.752 50 40 FFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@@H](C)CC)cc1OCC 408801072 SLDNCTPOQMCVQL-KNGSKEOJSA-N 374.437 2.849 50 40 FFGB C[C@H]1S/C(=C(\C#N)C(=O)NCc2ccco2)N(c2ccc(F)cc2)C1=O 4295601 AUJJDEKTEYLISW-AFMLGWFNSA-N 371.393 2.939 50 40 FFGB N#Cc1ccc(/C=N/NC(=O)c2ccc(Cn3cc(Cl)cn3)o2)cc1 695711 NNPSZWFMGIFLNN-DNTJNYDQSA-N 353.769 2.813 50 40 FFGB COc1ccc2c(c1)/C(=N/NC(=O)c1ccc(Br)cc1)C(=O)N2 4696004 GLMWPLRVAZBGAB-UHFFFAOYSA-N 374.194 2.544 50 40 FFGB O=C(NN=C1CCCCCC1)c1cccc(S(=O)(=O)N2CCCC2)c1 6674130 JQHLNSAVXOWIQK-UHFFFAOYSA-N 363.483 2.911 50 40 FFGB COC(=O)Oc1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1OC 408867133 JMQQGOFDAAIVKL-YBFXNURJSA-N 358.350 2.613 50 40 FFGB O=C(NN1C(=O)[C@@H](Cl)[C@@H]1c1ccccc1Cl)c1ccccc1O 1633513 ZOODFJBHTYHNCK-KBPBESRZSA-N 351.189 2.881 50 40 FFGB CCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(SC)cc2)cc1 59444409 QFYKSDORGYAJDX-XDHOZWIPSA-N 357.435 2.896 50 40 FFGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1ccc2c(c1)OCO2 5267583 JFKAUSOXDDDCGT-CQSZACIVSA-N 370.386 2.790 50 40 FFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCCc1cccs1 6402874 BTCZFLZCMUTPMD-GFCCVEGCSA-N 350.415 2.825 50 40 FFGB Cc1cc(C)nc(NNC(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)n1 14510724 MEIAZBRVHJCJFJ-AWEZNQCLSA-N 369.469 2.653 50 40 FFGB CCn1c(O)c(C(=O)N/N=C/c2ccc(F)cc2)c(=O)c2ccccc21 5791791 ISHODVINKVSZHA-SRZZPIQSSA-N 353.353 2.630 50 40 FFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3cccc(Cl)c3)CC2=O)cc1 409273272 WTDYIKOZUVKSKM-LRXPYSHVSA-N 371.824 2.852 50 40 FFGB CCOC(=O)N/N=C/c1ccc(OS(=O)(=O)c2ccc(F)cc2)cc1 409021120 YDALHUBLMQILBW-WOJGMQOQSA-N 366.370 2.673 50 40 FFGB O=C(O)[C@@H]1C[C@H](Cl)[C@@H](Sc2ccc([N+](=O)[O-])cc2)C[C@H]1C(=O)O 36550945 RMVAPMUOFNYPCC-WYUUTHIRSA-N 359.787 2.858 50 40 FFGB O=C(NNC(=O)[C@@H]1Cc2ccccc2S1)[C@@H]1Cc2ccccc2S1 40158826 MZPFEIFWEXCNNX-HOTGVXAUSA-N 356.472 2.568 50 40 FFGB COc1ccc(NC(=S)NNC(=O)Cc2c[nH]c3ccccc23)cc1 33808201 PNLHBEAFOAYELH-UHFFFAOYSA-N 354.435 2.737 50 40 FFGB CCN(CC)S(=O)(=O)c1ccc(Cl)c(NC(=O)[C@@H](C)Cl)c1 3887311 DBSVVISNWNONNM-SECBINFHSA-N 353.271 2.936 50 40 FFGB C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)COc1ccc(C)cc1 4561517 JOQXLIVUTOQWQS-PXLXIMEGSA-N 354.410 2.598 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccccc2C)ccc1OCC(=O)O 4544343 NLBTUOSKYDMEPO-RGVLZGJSSA-N 356.378 2.621 50 40 FFGB COc1ccccc1NC(=O)NNC(=O)c1ccccc1-n1cccc1 5636864 HLOKWBAKLVHCJK-UHFFFAOYSA-N 350.378 2.952 50 40 FFGB COc1ccc(OCC(=O)N/N=C(\C)c2cc(OC)ccc2OC)cc1 5752798 SPSMCABCSCXKOG-DEDYPNTBSA-N 358.394 2.632 50 40 FFGB CC[C@@H](NNC(=O)c1cn(C)c2ccccc12)C(=O)Nc1ccccc1 8747428 MGVWVPSFMKTPMS-QGZVFWFLSA-N 350.422 2.830 50 40 FFGB COc1cccc2cc(C(=O)N/N=C/c3ccc(O)c([N+](=O)[O-])c3)oc12 408961156 AVXMNJFBSIRALR-GIJQJNRQSA-N 355.306 2.819 50 40 FFGB Cc1cc(C(=O)NN)cc(C)c1OC(=O)c1ccc(Br)cc1 256052979 PMWGMCMFTZPTDP-UHFFFAOYSA-N 363.211 2.889 50 40 FFGB O=C(N/N=C/c1ccc(OCc2ccc(Cl)cc2)cc1)C(=O)NC1CC1 8219740 NVBCTTOCMBWKBQ-SRZZPIQSSA-N 371.824 2.648 50 40 FFGB CCOC(=O)NNC(=O)c1ccc(-c2nnc(-c3ccccc3)o2)cc1 23241876 LUBSMSFZYNGQQD-UHFFFAOYSA-N 352.350 2.795 50 40 FFGB Cc1cc(Br)cc2c1NC(=O)/C2=N\NC(=O)c1ccc(O)cc1 12445820 XITXSXBVFVWQCD-UHFFFAOYSA-N 374.194 2.549 50 40 FFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(SC)cc1 58884905 KRKLOCGQWJVWEU-XDHOZWIPSA-N 357.435 2.896 50 40 FFGB C/C(=N\NC(=O)c1cc(O)c(O)c(O)c1)c1ccc(Br)s1 15938830 VKDMBXWEPZWDKB-GIDUJCDVSA-N 371.212 2.781 50 40 FFGB CCOC(=O)[C@@](CCC(=O)O)(CCC(C)C)C(=O)CBr 2322834 KOEVCUOEWPTRGU-CQSZACIVSA-N 351.237 2.801 50 40 FFGB COc1ccc(CC(=O)N/N=C(/C)CC(=O)N(C)c2ccccc2)cc1 4462594 JCAFDTBMPMTSSA-QNGOZBTKSA-N 353.422 2.783 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)CN2Cc3cc(C)c(C)cc3C2)cc1 8336791 XLXVGNJZXWTGQQ-LSHDLFTRSA-N 365.433 2.556 50 40 FFGB O=C(NNC(=O)c1cc(C2CC2)nn1-c1ccccc1)c1cccs1 7987011 LYIHIWUFMJRCFO-UHFFFAOYSA-N 352.419 2.886 50 40 FFGB CSc1ncc(C(=O)NNc2nc(C)cc(C)n2)n1-c1ccccc1 14514608 NKDIKBXMXVSRDU-UHFFFAOYSA-N 354.439 2.758 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc3ccccc3c2)c1 5612224 KWAFCFYJDCGILU-UHFFFAOYSA-N 350.374 2.932 50 40 FFGB Cc1cc(C(=O)NN[C@H](C(=O)N2CCCCC2)c2ccccc2)c(C)o1 15472885 YGPNFSDMDFYLHU-SFHVURJKSA-N 355.438 2.885 50 40 FFGB O=C(N/N=C/C=C/c1cccc([N+](=O)[O-])c1)[C@H]1COc2ccccc2O1 3140276 KWQUAZBGXISWHK-TXCSVSJBSA-N 353.334 2.550 50 40 FFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(F)c3Cl)[C@@H]2C1 19943539 XUJIVEHZIUKGDK-ZBFHGGJFSA-N 367.815 2.834 50 40 FFGB CCOc1cccc(-c2cc(C(=O)N/N=C/c3cccc(O)c3)[nH]n2)c1 946214 KNXWVTLRERCUDH-UDWIEESQSA-N 350.378 2.945 50 40 FFGB COc1ccc([C@@H]2CC(=O)NC(SCC(=O)NCC(C)C)=C2C#N)cc1 6306821 DXLREVWPMFAYSC-HNNXBMFYSA-N 373.478 2.539 50 40 FFGB CCOC(=O)/C(=N/NC(=O)COc1cc(C)cc(C)c1)c1ccccc1 6940108 MNAHBQJPHDOGTE-ZBJSNUHESA-N 354.406 2.766 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccccc2)cc(Br)c1O 1429140 WPWIAVYVCDAXEL-VCHYOVAHSA-N 363.211 2.856 50 40 FFGB N#CC1=C[C@H]2CN(Cc3ccccc3)[C@H]1[C@H]1C(=O)N(c3ccccc3)C(=O)[C@@H]12 100366770 MPBVULAEDBTSOF-FYZZASKESA-N 369.424 2.756 50 40 FFGB Cc1nc(C)c(C(=O)NNS(=O)(=O)c2ccc3ccccc3c2)s1 3203516 JVGGOADXPQAIDR-UHFFFAOYSA-N 361.448 2.536 50 40 FFGB CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCCO3)cc1 409366105 SQGTXGLMCIBDCD-KGENOOAVSA-N 354.406 2.939 50 40 FFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)C)c32)cc(OC)c1OC 5633514 AQXRGZIUDXGFHP-CQSZACIVSA-N 370.409 2.777 50 40 FFGB CCOc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc([N+](=O)[O-])c1O 17074388 CAZHQBFCYZCVHJ-ZHYKGULVSA-N 361.398 2.976 50 40 FFGB N#C/C(=C\c1cnn(Cc2ccccc2Cl)c1)C(=O)NC[C@@H]1CCCO1 17700368 VSRHTUWISLFENL-BDBSJLECSA-N 370.840 2.787 50 40 FFGB COc1cc(NC(=O)C/C(C)=N/NC(=O)c2ccccc2O)cc(OC)c1 18093808 GOGQEFDANYKILK-CIAFOILYSA-N 371.393 2.544 50 40 FFGB CCOc1ccc(C(=O)N/N=C/c2cc(OCC)c(O)c([N+](=O)[O-])c2)cc1 20763904 SYBUIACYPNPNKO-YBFXNURJSA-N 373.365 2.862 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc1C 2134275 UKQWTRJZFLXIQL-VCHYOVAHSA-N 358.354 2.674 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1cc2c(s1)-c1ccccc1CC2 103121012 VUWAOEAIPBQEDW-PTNGSMBKSA-N 352.415 2.996 50 40 FFGB Cc1cc2c(c(=O)[nH]1)[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 18266082 YVHJWRQOGJCODU-CYBMUJFWSA-N 358.195 2.664 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)CN2CCCCC2)cc1Br 20244010 MWUINGCDFJHIIO-LDADJPATSA-N 368.275 2.784 50 40 FFGB C=CCc1cc(/C=N\NC(=O)c2cccs2)cc(OC)c1OCC(=O)O 138550243 URGSZWUWMZMYBD-GRSHGNNSSA-N 374.418 2.713 50 40 FFGB O=S(=O)(Cc1ccccc1)C[C@@H](Br)CBr 2033542 BWGFANVMJTUWDD-JTQLQIEISA-N 356.079 2.760 50 40 FFGB Cc1cc(/C=N/NC(=O)CC#N)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 59248889 MUQLBSYJILVIBR-AWQFTUOYSA-N 358.785 2.810 50 40 FFGB N#CC1=C(S)N(c2ccccc2)[C@H](c2ccc([N+](=O)[O-])cc2)NC1=O 9111551 YPMMNRNKQVSJHB-OAHLLOKOSA-N 352.375 2.895 50 40 FFGB COc1ccc(OCC(=O)N/N=C\c2cccn2-c2ccc(O)cc2)cc1 409023760 OTNITWWBGMKUGD-BKUYFWCQSA-N 365.389 2.721 50 40 FFGB COc1cc([N+](=O)[O-])cc(/C=N\NC(=O)c2cc3ccccc3o2)c1O 408849829 ZMDLUTCTYHNXMK-NVMNQCDNSA-N 355.306 2.819 50 40 FFGB COc1cccc(/C=C(/C#N)C(=O)NC2CCCCC2)c1O[C@H](C)C(=O)O 409246356 BMWVKNRVUCFHGE-LKKYZFDUSA-N 372.421 2.903 50 40 FFGB CCS(=O)(=O)[C@H](Br)C(=O)c1ccc(Br)cc1 96517865 RQAAZUVOLBAJAQ-JTQLQIEISA-N 370.062 2.788 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)C1(O)c2ccccc2-c2ccccc21 3140567 GUUHLHBLTSUTBM-LPYMAVHISA-N 373.368 2.961 50 40 FFGB COc1cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])ccc1Cl 880379 MOLNJMVOPJXTHG-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB Cn1c(SCC(=O)N/N=C/c2ccccc2C(=O)O)nc2ccccc21 946851 DYMNKQRDSBIORK-VXLYETTFSA-N 368.418 2.514 50 40 FFGB Cc1ccc2c(c1)[C@@H](N[C@@H](Cc1ccccc1)C(=O)O)[C@H](Cl)C(=O)O2 4974357 ADWQHMXRYKUWAT-BHYGNILZSA-N 359.809 2.848 50 40 FFGB CCOC(=O)c1ccc(NC(=O)C(=O)N/N=C/c2cccc(Cl)c2)cc1 59434122 FUUJZWBFXPRVMH-RGVLZGJSSA-N 373.796 2.606 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])c(O)c1)c1cccc(Br)c1 36245304 RAKDYKWBAFATIE-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)c3ccco3)cc2)cc1 3305531 MSBDFPJOKIKHMM-UHFFFAOYSA-N 361.357 2.658 50 40 FFGB CCOc1cc(/C=N/NC(C)=O)ccc1OCC(=O)Nc1ccccc1C 409009393 FEYVTHNARCSWSF-CIAFOILYSA-N 369.421 2.881 50 40 FFGB C/C(N)=C(/C#N)C(=O)COC(=O)c1cc2c(s1)-c1ccccc1CC2 5303060 VUWAOEAIPBQEDW-RVDMUPIBSA-N 352.415 2.996 50 40 FFGB CCS(=O)(=O)[C@H](I)C(=O)c1ccc(Cl)cc1 96517953 CKBMAEJESTXBIL-JTQLQIEISA-N 372.611 2.719 50 40 FFGB C#CCn1cc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)c2ccccc21 6295451 HMVXGPNHWDZIHY-FOKLQQMPSA-N 374.400 2.565 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)(C)C)c2C)cc1 408831204 OWUJCWTUGNVBTK-CIAFOILYSA-N 354.454 2.767 50 40 FFGB CC1(CC(=O)N/N=C/c2cccc(OCc3ccccc3)c2)OCCO1 409047041 MFWGELDVRBEAER-KGENOOAVSA-N 354.406 2.869 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@@H]1c1ccc([N+](=O)[O-])cc1 4742299 IKFJDPLWPZJNGD-OAHLLOKOSA-N 373.324 2.736 50 40 FFGB CCOc1ccc([C@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CCC3)cc1 690921 MJUWAAAEVYOMQR-SFHVURJKSA-N 352.438 2.662 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)[C@H]1C[C@@H]1c1ccccc1 872291 HCSOFUOFDZTDKE-CVEARBPZSA-N 358.825 2.978 50 40 FFGB COc1cccc(N2C[C@@H](C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2=O)c1 7928724 NRTLNYACPKILLM-LBPRGKRZSA-N 356.334 2.562 50 40 FFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@H](c1ccccc1)C(C#N)=C(N)O2 2258130 RXXVCDUJUZJSCT-MAUKXSAKSA-N 363.417 2.554 50 40 FFGB CCCCOc1ccc(C(=O)NNC(=O)c2cc(Cl)c[nH]2)cc1OC 9365511 HYMAPUWXXOSQBF-UHFFFAOYSA-N 365.817 2.930 50 40 FFGB COc1cccc(NC(=O)/C(C#N)=C/c2cc3c(cc2OC)OCO3)c1 409107164 VLRXXCFDRYHTRH-AWNIVKPZSA-N 352.346 2.978 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2)ccc1O[C@H](C)C(=O)O 409011358 HHURFUDLBYNKBY-AYPRBGQRSA-N 356.378 2.619 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(OC)c(OC)c2)c(OC)c1 409365058 PSYDHOIDCFJPAE-FYJGNVAPSA-N 372.421 2.804 50 40 FFGB CC(=O)Nc1ccc(CNS(=O)(=O)c2ccc(CCCl)cc2)cc1 32935914 LCHDUHRAWICMHW-UHFFFAOYSA-N 366.870 2.905 50 40 FFGB Cc1nn(-c2ccccc2)c2c1[C@@]1(C(=O)Nc3ccccc31)C(N)=C(C#N)O2 585145624 GVYCXRICPOJPHE-OAQYLSRUSA-N 369.384 2.505 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1ccc2c(c1)nc(C)n2-c1ccccc1 104321588 WUJSFTYSAJZVHI-LGMDPLHJSA-N 374.400 2.816 50 40 FFGB Cc1ccccc1C[C@H]1S/C(=C(/C#N)C(N)=O)N(c2ccccc2)C1=O 2376706 WTIFUCLUFDINKP-XUMLYMLNSA-N 363.442 2.907 50 40 FFGB C/C(=N\NC(=O)c1cccnc1)c1ccc(NC(=O)c2cccnc2)cc1 17074093 XSHTUUOZQYIEOD-ZVHZXABRSA-N 359.389 2.883 50 40 FFGB C[C@]12CC[C@@H]3[C@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1C[C@@H](O)[C@]2(O)C#N 70669931 VZFYGLAXUCFBQI-MZPCJNTCSA-N 373.493 2.918 50 40 FFGB biogenic Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(I)o2)n1 408976942 HETIMSWWGOIGNL-UXBLZVDNSA-N 367.146 2.945 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)COc2cc(C)ccc2C)c1 5793728 MTCLWLDMLAOIEK-UHFFFAOYSA-N 356.422 2.525 50 40 FFGB N#CCOc1ccccc1/C=C(/C#N)C(=O)N1CCN(c2ccccc2)CC1 59333369 RBXZZIXSPROXAV-MNDPQUGUSA-N 372.428 2.845 50 40 FFGB O=C(N/N=C/c1ccc(N2CCOCC2)s1)c1c[nH]c2ccccc12 3236992 KHHAKZSPJZTKCZ-RGVLZGJSSA-N 354.435 2.830 50 40 FFGB CC(C)c1ccc(NC(=S)NNC(=O)CN2CCCCCC2=O)cc1 13040984 QFEWTHQOHPTIBA-UHFFFAOYSA-N 362.499 2.530 50 40 FFGB C/C(Cn1nnc2ccccc21)=N\NC(=O)c1cccc(Br)c1 4610970 NTJOWWVSWDLOPZ-WOJGMQOQSA-N 372.226 3.000 50 40 FFGB COc1ccc(OCC(=O)N/N=C(\C)Cc2ccc(OC)c(OC)c2)cc1 4679738 SCGGXIYEBQEORV-KGENOOAVSA-N 372.421 2.826 50 40 FFGB O=C(CSc1ccc2ccccc2n1)N/N=C1/C(=O)Nc2ccccc21 17823409 SHCJCTWCSOYBIP-UHFFFAOYSA-N 362.414 2.800 50 40 FFGB COc1cccc(/C=N/NC(=O)C(=O)NC(C)C)c1Nc1ccccc1C 408706752 DDKTWKWKNWJVJJ-CIAFOILYSA-N 368.437 2.722 50 40 FFGB O=C(CCl)N(c1ccc(C(F)(F)F)cc1)[C@@H]1C=CS(=O)(=O)C1 217385803 CLRLFHURXJRROJ-LLVKDONJSA-N 353.749 2.588 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)Cc1cccs1 100883791 OXRDUOZGMADGRI-UDWIEESQSA-N 373.434 2.583 50 40 FFGB Cc1nc(C)c2c(C)c(C(=O)NNC(=O)c3ccccc3F)sc2n1 29604553 WPQYPMNDUNAIJA-UHFFFAOYSA-N 358.398 2.830 50 40 FFGB CCCc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1 7379720 BPMMBSHTELQEDR-UHFFFAOYSA-N 364.492 2.813 50 40 FFGB CC(=O)Nc1cccc(C(=O)NNC(=O)CSc2ccc(C)cc2)c1 9909949 YUIGBJABKWVEHV-UHFFFAOYSA-N 357.435 2.507 50 40 FFGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)CNC(=O)/C=C/c1ccccc1 2232602 JAQOYZQJWJMDKR-SJXYQCNRSA-N 360.417 2.756 50 40 FFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2ccccc2o1 59417748 CBMBUXUUTWQOHU-QGMBQPNBSA-N 353.290 2.834 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)N2CCCCC2)c(C)n1-c1ccccc1 59959951 WHDNJFYUWQSHBR-KGENOOAVSA-N 352.438 2.557 50 40 FFGB CC[C@@H](C)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 12919092 XBLGFJSHOKSKCS-CQSZACIVSA-N 363.421 2.741 50 40 FFGB CCn1c(NNC(=O)/C=C/c2cccc(OC)c2)nc2ccccc2c1=O 32904536 AWQVRUIDHBVNEC-VAWYXSNFSA-N 364.405 2.582 50 40 FFGB O=C(OCc1ccccc1)N1CC[C@@H](CN(C(=O)CCl)C2CC2)C1 79392758 GXSPIXCNUNNWJI-OAHLLOKOSA-N 350.846 2.875 50 40 FFGB CN1C(=O)/C(=N/NC(=O)c2cccc(Br)c2)c2ccccc21 18240620 INNKKRJUOSULLJ-NBVRZTHBSA-N 358.195 2.560 50 40 FFGB O=C(N/N=C/c1ccc(F)cc1)C(=O)Nc1ccccc1Br 59435807 PFBJMNPBQPTYSL-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 3375357 GFHOTFHXOHDECF-UHFFFAOYSA-N 355.785 2.506 50 40 FFGB C#CCOc1c(Br)cc(/C=C(\C#N)C(=O)OCC)cc1OC 113855380 UOGGUHMAGZSXHR-KPKJPENVSA-N 364.195 2.940 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(Br)o1 408724811 CTRMSSNZJRGNRP-OVCLIPMQSA-N 352.144 2.643 50 40 FFGB Cc1cc(C(=O)NN[C@H](C(N)=O)c2ccccc2)c(C)n1-c1ccccc1 26223724 YEAQAJNZEPZDAM-IBGZPJMESA-N 362.433 2.555 50 40 FFGB CC(=O)Nc1sc(C(=O)N/N=C/c2ccc(N(C)C)cc2)c(C)c1C#N 408722865 XVVMOUPDAALIEP-KEBDBYFISA-N 369.450 2.717 50 40 FFGB Nc1ccccc1C(=O)N/N=C/c1cccc(I)c1 33615039 KXUSDPSHTDXUQE-RQZCQDPDSA-N 365.174 2.637 50 40 FFGB O=C(N/N=C/c1ccccc1F)C(=O)Nc1ccc(Br)cc1 13921829 DXNUNWUTSBCLQP-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])C2 8336804 CIUJZVJGHJBURN-AWQFTUOYSA-N 352.394 2.678 50 40 FFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc2c(c1)OCO2 716746 WUOPPXRAFWSMBD-QGMBQPNBSA-N 373.390 2.707 50 40 FFGB COc1cccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1 59483742 DHDFCXQJIRZDBW-CIAFOILYSA-N 369.421 2.819 50 40 FFGB Cc1noc2ncc(C(=O)NNC(=O)Cc3cccc4ccccc34)cc12 43123104 LGPNKJLJCAORCV-UHFFFAOYSA-N 360.373 2.688 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C(/CCC(=O)O)c1ccccc1 15229840 JBLRUELRAORVSA-PGMHBOJBSA-N 370.405 2.849 50 40 FFGB CCOc1cc(Br)cc(/C=N/NC(=O)c2ccncc2)c1O 2358797 OGZQAMPMGBFXKZ-GIJQJNRQSA-N 364.199 2.712 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)N2CCC(c3ccccc3)CC2)c1 12758448 BZPOPSVQLGHRAM-UHFFFAOYSA-N 367.449 2.994 50 40 FFGB O=C(CCCSc1nncs1)NNC(=O)c1ccc(Cl)cc1 3372979 OELFFBOVQLSXAN-UHFFFAOYSA-N 356.860 2.525 50 40 FFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 17073276 KPVIZISEJCAJQZ-UDWIEESQSA-N 354.366 2.636 50 40 FFGB O=C(CCl)N1C(=O)c2cccnc2N(C(=O)CCl)c2ccccc21 4106809 ZZOPSCIOBIAXHC-UHFFFAOYSA-N 364.188 2.711 50 40 FFGB COc1ccc(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)cc1 15423083 MUMDGYJWHXRZOJ-AWEZNQCLSA-N 371.275 2.950 50 40 FFGB O=C(NNC(=O)[C@H](Oc1ccccc1)c1ccccc1)C(Cl)Cl 104119388 NMKLUIWWTBULQP-CYBMUJFWSA-N 353.205 2.758 50 40 FFGB O=C(N/N=C\c1ccc(Br)cc1)c1cc([N+](=O)[O-])ccc1O 408918669 NOFPUMOUBNZDKH-PXNMLYILSA-N 364.155 2.827 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1 1079014 HVGRZPJJQMOJAK-RGVLZGJSSA-N 372.446 2.622 50 40 FFGB O=C(COc1ccccc1Cl)NNC(=O)c1cc2cc(F)ccc2[nH]1 12984832 PWUAQDJPFXBLRN-UHFFFAOYSA-N 361.760 2.800 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)C(O)(c1ccccc1)c1ccccc1 873089 BMTOULDIHOXTDZ-DEDYPNTBSA-N 365.345 2.574 50 40 FFGB Cc1cc(C)n2nc(C(=O)N/N=C/c3ccc(Cl)cc3Cl)nc2n1 1226049 WTTXHDLZMBDECW-CNHKJKLMSA-N 363.208 2.812 50 40 FFGB Cc1cc2c(c(=O)n1C)[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 4248289 HAPFDQXKNWJAFE-AWEZNQCLSA-N 372.222 2.674 50 40 FFGB Cc1ccc(NCC(=O)N/N=C/c2ccc(O[C@H](C)C(=O)O)cc2)cc1C 408856002 PADCSGVGEQDMSJ-XHADFYDMSA-N 369.421 2.718 50 40 FFGB CC[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccccc1 7647227 SVQAMXAURAUBEU-MRXNPFEDSA-N 374.824 2.838 50 40 FFGB C/C(=N/NC(=O)CNC(=O)CCc1ccccc1)c1ccc(Cl)cc1 4806756 KUHBEFQDFRNXNN-HMAPJEAMSA-N 357.841 2.929 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(OC2CSC2)cc1 408861233 ALLYAILGONLPGI-KEBDBYFISA-N 372.446 2.719 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OC)c(OC)c2)cc1 193794048 BRLAXRDPJYQIGC-YBEGLDIGSA-N 352.390 2.936 50 40 FFGB CN(C)C(=O)/C(C#N)=C\c1ccccc1OCc1ccc(C(=O)O)cc1 59334922 KDRJWKWSMPQKFP-BOPFTXTBSA-N 350.374 2.959 50 40 FFGB O=C(N/N=C/c1ccc(O)c(I)c1)c1ccccc1 4784667 UDLRLRBMYWRONK-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB Cc1cccc(C)c1-n1c(C)cc(/C=N/NC(=O)C(=O)N2CCCC2)c1C 408885120 WUQNJIKMYSFBMV-LPYMAVHISA-N 366.465 2.783 50 40 FFGB Cc1occc1C(=O)NNC(=O)NCCOc1ccc2ccccc2c1 40068965 RZRBTTUCYLFDMJ-UHFFFAOYSA-N 353.378 2.764 50 40 FFGB CC(=O)Nc1ccccc1NC(=O)C/C(C)=N/NC(=O)Cc1cccs1 101960394 KROOYQLFJHYMJI-CIAFOILYSA-N 372.450 2.770 50 40 FFGB Cc1ccc(-n2nc(C)c(CC(=O)NNc3ncccn3)c2C)cc1Cl 48237393 RZBBLOOWHUNDCG-UHFFFAOYSA-N 370.844 2.927 50 40 FFGB Cc1ccc(C)c(OCC(=O)N/N=C/c2ccc(N3CCOCC3)cc2)c1 6415207 BWSZBGYLXJIZEC-HYARGMPZSA-N 367.449 2.669 50 40 FFGB COc1ccccc1NCC(=O)N/N=C\C=C\c1cccc([N+](=O)[O-])c1 4711917 CHHYUZKOLDYTHT-QBEBGYDGSA-N 354.366 2.831 50 40 FFGB CCN1C(=O)C(=CNc2ccc(SC#N)cc2C)C(=O)N(CC)C1=S 8484641 YIUYRXBIFIBMHB-UHFFFAOYSA-N 374.491 2.860 50 40 FFGB Cc1nc2ccc(Br)cn2c1C(=O)N/N=C/c1ccccc1O 1090755 CHWFXEHUSBZZDB-QGMBQPNBSA-N 373.210 2.875 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)COc2cccc3cccnc23)c1 169527563 XFGHTJBATLPRCA-WSDLNYQXSA-N 365.389 2.781 50 40 FFGB Cc1ccc(C)c(OCC(=O)NNC(=O)Cc2c(F)cccc2Cl)c1 6333620 GNRACYWQNXJRSW-UHFFFAOYSA-N 364.804 2.865 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 59474259 AREQFBKWWSOHLB-VCHYOVAHSA-N 359.407 2.987 50 40 FFGB O=C(O)COc1ccc(/C=N/NC(=O)c2ccccc2F)cc1Cl 59250519 PZXYQLYANHEZMX-UFWORHAWSA-N 350.733 2.706 50 40 FFGB O=C(CCC1CCCC1)NNC(=O)COc1ccc(Br)cc1 2617756 KBQDZBPPSHCSLU-UHFFFAOYSA-N 369.259 2.946 50 40 FFGB Cc1ccc(C)c(S(=O)(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1 8753669 XDOADMCGXVGQMU-UHFFFAOYSA-N 371.418 2.582 50 40 FFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)cc1 408611085 PWVQYMYNWWVDHA-OFJBCHTGSA-N 371.412 2.770 50 40 FFGB Cc1cc(C)nc(Sc2ccc(/C=N/NC(=O)c3ccncc3)o2)n1 409149398 FCOPADNYPOGRRN-VXLYETTFSA-N 353.407 2.997 50 40 FFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2ccccc2OC)cc1 5370145 FKBBLUNZKAYZPO-HYARGMPZSA-N 369.421 2.767 50 40 FFGB Cc1ccc(C(=O)CCC(=O)NNC(=O)c2ccc3c(c2)CCC3)s1 9154017 AOEGSTDZLAABHR-UHFFFAOYSA-N 356.447 2.969 50 40 FFGB COC(=O)c1ccc(/C=N/NC(=O)CSCc2ccc(OC)cc2)cc1 5513741 CKVZTEKZLBPUGQ-RGVLZGJSSA-N 372.446 2.865 50 40 FFGB O=C(CNc1cccc(Br)c1)N/N=C\c1ccc([N+](=O)[O-])o1 4711939 YJCUIVGOAPWKIT-APSNUPSMSA-N 367.159 2.513 50 40 FFGB CC(=O)O[C@@]12[C@H]3[C@@H]4C[C@H]5[C@@H]([C@H]4[C@H]1Br)[C@H]2[C@@H](Br)[C@H]53 245232068 OWYYCXRWCMJAHL-XBDOOMGESA-N 362.061 2.587 50 40 FFGB COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1 96299735 USOARPJXUZUQNF-MRXNPFEDSA-N 358.353 2.836 50 40 FFGB CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(C)=C(C)C[C@H]2C(=O)O)cc1 2797212 NQQSZLWXQJHCBC-IAGOWNOFSA-N 374.437 2.684 50 40 FFGB CCCNC(=O)/C(C#N)=C/c1cc(Br)c(O)c(OCC)c1 4615235 QGAGPADRDINKQB-IZZDOVSWSA-N 353.216 2.987 50 40 FFGB O=C(CSc1ccc(Cl)cc1)NNC(=O)c1n[nH]c2ccccc12 6648687 OMYOYSKBCFSRLX-UHFFFAOYSA-N 360.826 2.770 50 40 FFGB CC1=C(C#N)C(=O)N(C[C@@H]2CCCO2)C(=O)/C1=C\c1ccc(N(C)C)cc1 16753063 VGCFAKBJQIZZNB-PBXDPIQXSA-N 365.433 2.524 50 40 FFGB Cc1ccc(CSCC(=O)N/N=C2/C(=O)N(C)c3ccccc32)cc1 409339095 DXGUGDDTZSRUCF-DYTRJAOYSA-N 353.447 2.725 50 40 FFGB N#CCC(=O)N/N=C(\CNC(=O)c1ccccc1Cl)c1ccccc1 18191650 HESRDNOTHYFCAZ-CJLVFECKSA-N 354.797 2.504 50 40 FFGB O=C(CSc1nc2ccccc2o1)N/N=C/c1cccc([N+](=O)[O-])c1 1478009 DIUVGFWPQGWNKS-RQZCQDPDSA-N 356.363 2.978 50 40 FFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@H](c1cccs1)C(C#N)=C(N)O2 1263964 HEIMWOLXZMZGBF-LRDDRELGSA-N 369.446 2.615 50 40 FFGB COc1ccc(OC)c([C@H]2CCCN2C(=O)NNC(=O)c2ccccc2)c1 53954803 LBYKTYABWSXFFG-QGZVFWFLSA-N 369.421 2.895 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)CCc2c[nH]c3ccccc23)c1 12865128 QETFDZLVOKAZEH-UHFFFAOYSA-N 367.405 2.579 50 40 FFGB C/C(=N\NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O)c1ccccc1 408907821 STCDKYJGRPJVOY-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB C[C@@]12CC[C@@H]([C@](Br)([N+](=O)[O-])C1=O)[C@@]2(C)CBr 35986574 QNOPRINAANCQME-QQRDMOCMSA-N 355.026 2.755 50 40 FFGB NNC(=O)c1cc(-c2ccc(Br)cc2)n(-c2ccccc2)n1 225310565 PHEYZWNOJVLIBV-UHFFFAOYSA-N 357.211 2.905 50 40 FFGB O=C(NCCCl)c1cccn(Cc2ccc(C(F)(F)F)cc2)c1=O 5670301 KDAXWBNZYIBGJJ-UHFFFAOYSA-N 358.747 2.884 50 40 FFGB Cc1cccc(OCCCC(=O)NNC(=O)COc2cc(C)ccc2C)c1 17202993 HEKQYERRLNTSDV-UHFFFAOYSA-N 370.449 2.997 50 40 FFGB O=C(NCc1ccccc1)C(=O)N/N=C/c1c(Cl)cccc1Cl 5603219 RLJILDOTPVHFPK-KEBDBYFISA-N 350.205 2.760 50 40 FFGB Cc1ccc(C(=O)NNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)cc1 3362894 GNYQECOGNLJILV-SFHVURJKSA-N 354.406 2.628 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N\NC(=O)CC(=O)NC(C)C)c2C)cc1 4622109 OKLBUQCKUNCKDP-MTJSOVHGSA-N 354.454 2.767 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2C=CC[C@H]12)N/N=C1/C[C@@H]2C=CC[C@H]12 17073333 GIRIUIXSQOYDQJ-OIXBRBJOSA-N 354.454 2.683 50 40 FFGB Cn1cccc1-c1cc(C(=O)N/N=C\c2cccc(Br)c2)[nH]n1 31830141 IQMRFELEUOLRFF-ZDLGFXPLSA-N 372.226 2.942 50 40 FFGB CC(=O)Nc1ccc(/C=C2/SC(=S)N(C=C(C#N)C#N)C2=O)cc1 1637379 RCCCDCPONOAMFR-MKMNVTDBSA-N 354.416 2.777 50 40 FFGB CCn1c(O)c(C(=O)N/N=C/c2cccc(F)c2)c(=O)c2ccccc21 5557460 NIUUXQGYHGSICZ-SRZZPIQSSA-N 353.353 2.630 50 40 FFGB CC[C@@H](Nc1ccc(OC)cc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 695822 MVOPEQVVNOOQFL-MIQLPHMESA-N 356.382 2.944 50 40 FFGB C=CCNC(=O)/C(C#N)=C/c1ccc(OC(=O)c2ccncc2)c(OC)c1 1917727 OZNBNNCPXUUHTN-LFIBNONCSA-N 363.373 2.519 50 40 FFGB N#C/C(=C/c1ccc(OCC(N)=O)cc1)C(=O)Nc1ccc(Cl)cc1 59116856 DANACIOAXCTTAT-LCYFTJDESA-N 355.781 2.750 50 40 FFGB O=C(CCl)N(c1ccc(Cl)cc1Cl)[C@@H]1CCS(=O)(=O)C1 217380649 FFGGZNYCCXFSJA-SECBINFHSA-N 356.658 2.752 50 40 FFGB O=C(O)COc1ccccc1/C=N/NC(=O)c1cc2ccccc2cc1O 821821 WHELSFMZECZNSK-SRZZPIQSSA-N 364.357 2.773 50 40 FFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)NC2CCCC2)cc1OC 13897468 OVKSKSCQNFPFJH-XNTDXEJSSA-N 372.421 2.603 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)c2ccc(CN3CCOCC3)cc2)cc1 23358561 CLCNUTJMZYUEMU-CJLVFECKSA-N 367.449 2.681 50 40 FFGB COc1cccc(C(=O)N/N=C2/C(=O)Nc3ccc(Br)cc32)c1 59472613 XYCJJILIQYEALW-UHFFFAOYSA-N 374.194 2.544 50 40 FFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@H](c1ccccc1)C(C#N)=C(N)O2 2258128 RXXVCDUJUZJSCT-CRAIPNDOSA-N 363.417 2.554 50 40 FFGB C#CCOc1c(Cl)cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1OC 5045017 SAAUQVSTVHVIQB-OAHLLOKOSA-N 370.796 2.610 50 40 FFGB CCOC(=O)C/C(C)=N/NC(=O)CCC(=O)Nc1ccccc1Cl 4525801 UDTQVGHOUPNALD-YBFXNURJSA-N 353.806 2.504 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cccc(OC3CSC3)c2)cc1OC 4502774 IWPACDOXPZYUKN-KEBDBYFISA-N 372.446 2.962 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1cc2cc([N+](=O)[O-])ccc2o1 408965760 LUJWLUVAMIOEHU-CAOOACKPSA-N 370.277 2.719 50 40 FFGB FC(F)(F)C1(C(F)(F)F)[C@@H]2C[C@@H]3[C@@H]([C@@H]2I)N31 100122213 DTKNYSHMNMVGAO-UWLOJIEQSA-N 357.035 2.740 50 40 FFGB CCOC(=O)/C(C#N)=C/c1c(N2CCCCCC2)nc2ccccn2c1=O 2202379 WVZKMQVLCGWKAJ-FYWRMAATSA-N 366.421 2.545 50 40 FFGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1ccncc1 840410 GNTZIFRDIHKRCY-VIFPVBQESA-N 354.193 2.617 50 40 FFGB Cc1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1 6944574 CJGBSWKVSNGZEQ-LBPRGKRZSA-N 364.492 2.805 50 40 FFGB O=C(N/N=C1/CCCCc2ccccc21)c1csc(N2CCOCC2)n1 8498884 FNWRYBHLUJJLGI-PGMHBOJBSA-N 370.478 2.840 50 40 FFGB Cn1cccc1C(=O)NNC(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 73407500 LVEDJGUPEUODMV-RYUDHWBXSA-N 351.328 2.609 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)cc1 408611083 PWVQYMYNWWVDHA-LVCXCXRVSA-N 371.412 2.770 50 40 FFGB Cc1ncc(CO)c(/C=N/NC(=O)c2cc3c(s2)CC[C@H](C)C3)c1O 3455578 WHUZXTLITWMKSL-OTWRLEFPSA-N 359.451 2.538 50 40 FFGB C[C@]1(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)CC1(Cl)Cl 6016758 COVAEFJOWJKIEW-OAHLLOKOSA-N 366.204 2.955 50 40 FFGB Cc1cccc(C)c1N(CC(=O)NN=C1CCCCCC1)S(C)(=O)=O 714532 VYSYTMMNTUXOAR-UHFFFAOYSA-N 365.499 2.896 50 40 FFGB aggregator O=C(NNc1nc2c(F)cc(F)cc2s1)[C@H]1COc2ccccc2O1 4121499 BVWHGNUNLSHAIW-GFCCVEGCSA-N 363.345 2.858 50 40 FFGB C/C(CC(=O)Nc1ccc(F)cc1)=N\NC(=O)c1ccc([N+](=O)[O-])cc1 14923266 BHFMIBPPVFSBSW-RGVLZGJSSA-N 358.329 2.868 50 40 FFGB CC1=NN(c2ccc(C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)CC1 40144186 UFLGJMVKPZPEBZ-UHFFFAOYSA-N 368.462 2.898 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])s1)c1cncc(Br)c1 2353511 YEDSXCJEAFAHKT-MKMNVTDBSA-N 355.173 2.578 50 40 FFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1OC 59515516 WPMJZHILZMNDQX-CIAFOILYSA-N 369.421 2.916 50 40 FFGB O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(Cl)cc(Cl)c1 12807411 UAZRRUWBXJPKFW-CQSZACIVSA-N 367.188 2.594 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1cccc(-n2cccc2)c1 21198478 ZPOWYJNZKSLNMX-UHFFFAOYSA-N 350.447 2.786 50 40 FFGB COc1ccc([C@@H](C)NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2)cc1 2055063 JWAPFZCXSDKTDG-ZICWZVMQSA-N 359.813 2.676 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)nc(C)n3CC)cc1 15348215 BILYMYBDDADKFQ-UHFFFAOYSA-N 366.421 2.838 50 40 FFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(C)cc3)CC2=O)cc1 33907683 ZRUDTCNQWQGVLA-YQODDJSKSA-N 351.406 2.507 50 40 FFGB O=C(O)[C@@H](Br)Cc1ccc(I)cc1 225012472 AVRIYQQWTMXGRF-QMMMGPOBSA-N 354.969 2.682 50 40 FFGB CCOC(=O)c1cc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)c(C)nc1C 2696833 KHCYRLWCJGHRAZ-VXLYETTFSA-N 370.365 2.547 50 40 FFGB COc1cc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc(OC)c1OC 1444629 GGGFEQMIXGZINK-SRZZPIQSSA-N 372.421 2.858 50 40 FFGB CCN(NC(=O)CCn1c(C)nc2ccccc2c1=O)c1ccc(C)cc1 29776932 QSSIUZOYYHELML-UHFFFAOYSA-N 364.449 2.961 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2oc3ccccc3c2C)c2c(C)noc2n1 12623474 UMSGNVOPQOOOBU-UHFFFAOYSA-N 364.361 2.969 50 40 FFGB Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 59515548 DEWKNNRFZFOBTA-GIJQJNRQSA-N 360.757 2.645 50 40 FFGB O=C(NNC(=O)c1cc(Br)ccc1Cl)c1ccccc1O 13006604 FPYIFOVROBONNE-UHFFFAOYSA-N 369.602 2.883 50 40 FFGB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N/N=C/C1=Cc2ccccc2OC1 6615269 AKYCXTNVJLTLCJ-SVZNOHIVSA-N 371.437 2.964 50 40 FFGB N#C/C(=C\c1ccc(N2CCOCC2)o1)C(=O)Nc1cccc([N+](=O)[O-])c1 408788267 BVRLYOJMUXIEOI-JLHYYAGUSA-N 368.349 2.570 50 40 FFGB Nc1ccccc1C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1Br 408590024 NXHOFZHBMNFZMA-CAOOACKPSA-N 363.171 2.703 50 40 FFGB COc1cc(/C=N/NC(=O)C2(O)c3ccccc3-c3ccccc32)ccc1O 4278824 IMPXBHBALNQOGY-YDZHTSKRSA-N 374.396 2.767 50 40 FFGB O=C(NNC(=O)c1ccc2ccccc2c1O)c1ccc([N+](=O)[O-])cc1 970902 DQTPRBVVESYCIZ-UHFFFAOYSA-N 351.318 2.528 50 40 FFGB COc1ccc(NC(=O)C(=O)N/N=C(/C)CCc2ccccc2)c(OC)c1 59515788 KWBOZXFPVHVOPN-HMAPJEAMSA-N 369.421 2.767 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC2CCCC2)c(C)n1-c1ccccc1 4091304 NGGSXKHCEZBVSH-FYJGNVAPSA-N 352.438 2.603 50 40 FFGB COc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1I 408775280 GGWFBZXTHJVXFE-WDZFZDKYSA-N 370.190 2.731 50 40 FFGB COC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1 33653743 NOFSDTCSQYUOTD-DHDCSXOGSA-N 350.330 2.717 50 40 FFGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccc(O)cc1O 5206322 VCYWFFXTIUSSHC-CAOOACKPSA-N 365.183 2.633 50 40 FFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(N3CCCCC3)o2)n1 8336688 NWJWPMHVDFAXEI-YBFXNURJSA-N 373.482 2.919 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c([N+](=O)[O-])cc1OC 4525094 PKXBODUSSWMLAB-KPKJPENVSA-N 369.333 2.863 50 40 FFGB O=C(N/N=C/c1ccccc1OCc1ccccc1)C(=O)N1CCCCC1 4696440 GLXTZUDEUKGORC-PXLXIMEGSA-N 365.433 2.728 50 40 FFGB N#CCOc1ccc(/C=N\NC(=O)COc2cccc3cccnc23)cc1 409017137 KMIPZUOGXBGDFS-QRVIBDJDSA-N 360.373 2.666 50 40 FFGB O=C(NNS(=O)(=O)/C=C/c1ccc(Cl)cc1)c1ccccc1F 16148701 QGLFJUOOMCNQIF-MDZDMXLPSA-N 354.790 2.714 50 40 FFGB C[C@@H]1C[C@H]1c1ccc(/C=C/C(=O)NNC(=O)COc2ccccc2C#N)o1 16205096 XLCNPCJJVPQKJY-TYPPYWKXSA-N 365.389 2.514 50 40 FFGB CC[C@H](C)NC(=O)/C(C#N)=C/c1cc2c(cc1Br)OCO2 408818579 WAXNXWHNGWBLPA-AXNBSVLLSA-N 351.200 2.999 50 40 FFGB Cc1nn(C)c(F)c1/C=N/NC(=O)c1ccc(COc2ccc(F)cc2)o1 252486008 HHBSYBKKFILIAV-ZVBGSRNCSA-N 374.347 2.943 50 40 FFGB CCO[C@@H](C)n1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253396855 FBWOQDNOLOKQAK-ZBEGNZNMSA-N 356.426 2.889 50 40 FFGB Cc1cc(O)nc(NN2[C@@H](Cl)C(=O)[C@H]2c2c(O)ccc3ccccc23)n1 16958252 LUMJNYMUQYSHKS-NVXWUHKLSA-N 370.796 2.867 50 40 FFGB N#C/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)N1CCOCC1 728278 CKYVOCSXTIFWCU-SDNWHVSQSA-N 353.334 2.621 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)C(=O)N[C@@H](C)c2ccccc2)cc1 7869270 JOULSQKLKNSDAG-HBBMIWKISA-N 353.422 2.803 50 40 FFGB CCN(CC)c1ccc(C(=O)N/N=C2/C(=O)N(C)c3ccccc32)cc1 6146876 KJJSJTGNIKKYKR-DYTRJAOYSA-N 350.422 2.643 50 40 FFGB COC(=O)c1cccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)c1 408970925 AUZKVUAUVZMERN-KEBDBYFISA-N 350.378 2.502 50 40 FFGB C/C(=N\NC(=O)c1ccncc1)c1ccc(I)cc1 13301293 HDVNCKZBTVOGEJ-LICLKQGHSA-N 365.174 2.840 50 40 FFGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(O)c([N+](=O)[O-])c2)cc1 16216764 PEMHZVVFJQWUHK-ZSOIEALJSA-N 353.334 2.532 50 40 FFGB CCc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 1211248 HWDCCBUXCADILZ-KOWBDXASSA-N 365.433 2.761 50 40 FFGB CC(C)Oc1ccc(/C=N/NC(=O)CC2(C)OCCO2)c(OC(C)C)c1 6762717 WXSJKHXRUADWNE-UDWIEESQSA-N 364.442 2.864 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1 409058650 SJVMIXANMQTJNL-FYJGNVAPSA-N 353.422 2.954 50 40 FFGB CNC(=O)/C(C#N)=C/c1cn(CC(=O)Nc2ccccc2)c2ccccc12 408762606 LIHCKHOJARXIEN-RVDMUPIBSA-N 358.401 2.933 50 40 FFGB O=C(S[C@H]1CS(=O)(=O)C[C@@H]1Cl)c1ccccc1Br 16789893 VYPSIHSPXGUPES-UWVGGRQHSA-N 369.689 2.727 50 40 FFGB CN1C(=O)/C(=N\NC(=O)CNc2cccc3ccccc23)c2ccccc21 100260603 SRNPJYQZMDSKKC-GFMRDNFCSA-N 358.401 2.749 50 40 FFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(O[C@H](C)C(=O)O)cc1 59248573 JTZLWZBBSARXRI-AYPRBGQRSA-N 356.378 2.619 50 40 FFGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)cc1 38184441 RTGLAIAJLXSGOC-VXLYETTFSA-N 370.365 2.659 50 40 FFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1ccccc1-n1cccc1 38364337 OOLBFGGMGJCZAQ-XDHOZWIPSA-N 350.334 2.855 50 40 FFGB COc1cc(/C=N\NC(=O)c2ccccc2-n2cccc2)cc(OC)c1O 30885290 QUYLDWSYFDUCDS-BKUYFWCQSA-N 365.389 2.964 50 40 FFGB Cc1ccc(COc2ccc(/C=N/NC(=O)C(=O)N3CCCC3)cc2)cc1 3089104 JJQPCJWZZSKUOZ-HYARGMPZSA-N 365.433 2.647 50 40 FFGB CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCc1ccccc1C#N 4513382 AXFYNJDTZSMEDC-YDZHTSKRSA-N 362.389 2.900 50 40 FFGB CC/C(Cc1ccccc1)=N\NC(=O)CC(=O)NCCc1ccccc1 6998732 ZACLFFYPNBNHSK-FCDQGJHFSA-N 351.450 2.860 50 40 FFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1OCC 409368497 YYDWDHRQXUDWDN-LFIBNONCSA-N 372.421 2.557 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc([N+](=O)[O-])c1O 36316684 BJQUEXWWMQOKNS-GIJQJNRQSA-N 363.757 2.655 50 40 FFGB CCCCOC[C@H](CCl)OC(=O)NS(=O)(=O)c1ccc(C)cc1 16639079 WPIOQNRMSASMIS-ZDUSSCGKSA-N 363.863 2.834 50 40 FFGB O=C(CSc1cccc2cccnc12)N/N=C/c1cc(O)cc(O)c1 1436929 BLJKQCBSQGWFOJ-KEBDBYFISA-N 353.403 2.888 50 40 FFGB Cc1cc(C(=O)NNC(=O)CCSCc2csc(C)n2)c(C)o1 36397255 QQPFEBYBBCXICW-UHFFFAOYSA-N 353.469 2.746 50 40 FFGB Cc1ccc(S(=O)(=O)/C(C#N)=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 2581786 FWZWVFYNNOYSEY-MKMNVTDBSA-N 372.358 2.970 50 40 FFGB CCN(NC(=O)C[C@H](NC(N)=O)c1cccc(C)c1)c1ccc(C)cc1 32423652 BXEVFSOXMNGMPA-SFHVURJKSA-N 354.454 2.961 50 40 FFGB C/C(=N/NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccc(N(C)C)cc1 5002711 JXGFZQUQOYYLNR-WQRHYEAKSA-N 371.353 2.723 50 40 FFGB COc1cc(OC)cc(C(=O)N/N=C/c2cc(Cl)c(O)c(OC)c2)c1 8339187 ABUSRMMINLAEFF-DJKKODMXSA-N 364.785 2.835 50 40 FFGB Cc1cc(OCC(=O)NNC(=S)NC2CCCCC2)ccc1Cl 938160 WXHLKNVVLUUYIA-UHFFFAOYSA-N 355.891 2.855 50 40 FFGB CC(C)CNC(=O)CSC1=C(C#N)[C@H](c2ccc(F)cc2)CC(=O)N1 6306818 MJRKQWLMTCOSHI-AWEZNQCLSA-N 361.442 2.670 50 40 FFGB N#Cc1ccc(C(=O)N/N=C/c2cn(CC(=O)O)c3ccccc23)c(F)c1 2398575 HDQLNJCDWNSLGE-LSFURLLWSA-N 364.336 2.501 50 40 FFGB O=C1Nc2ccc(Br)cc2/C1=N/NC(=O)c1cccs1 12629826 HXKSNJRKRVLTQB-UHFFFAOYSA-N 350.197 2.597 50 40 FFGB O=C1Nc2ccc(Br)cc2/C1=N\NC(=O)c1ccc(F)cc1 6058453 OAFUNAXQJPOVOB-UHFFFAOYSA-N 362.158 2.674 50 40 FFGB C=CCc1cc(/C=N/NC(=O)Cc2ccc(OC)cc2)cc(OC)c1O 4544376 VHKVFAGRANFJCU-FYJGNVAPSA-N 354.406 2.831 50 40 FFGB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1ccncc1 408822795 WOSAGYBPIXZTKM-YDZHTSKRSA-N 356.385 2.700 50 40 FFGB NNC(=O)/C=C/c1ccc(-c2ccc(Br)cc2[N+](=O)[O-])o1 226257746 CDTOJKDAOJSZGM-ZZXKWVIFSA-N 352.144 2.620 50 40 FFGB O=C(CCCCC(=O)N/N=C/c1cccs1)N/N=C/c1cccs1 2056022 CSFLSGNAHJOJPM-JYFOCSDGSA-N 362.480 2.970 50 40 FFGB CN1C(=O)/C(=N/NC(=O)COc2ccc(C(C)(C)C)cc2)c2ccccc21 5444100 PMVFRPBLAKWVDH-FCDQGJHFSA-N 365.433 2.860 50 40 FFGB O=C(CCCc1cccs1)NNC(=O)c1cc(-c2ccccc2)n[nH]1 6509138 KEXHFKIAFOXWNH-UHFFFAOYSA-N 354.435 2.922 50 40 FFGB Cc1c(/C=N/NC(=O)CN2CCCCC2)c(Cl)nn1-c1ccccc1 408891600 AIIIWFZVNBOAGD-UDWIEESQSA-N 359.861 2.770 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)CCc2nc3ccccc3s2)c1 12750577 LXWNESRXBZHQSP-UHFFFAOYSA-N 369.446 2.764 50 40 FFGB O=C(COCc1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1O 84505929 GSRPKTLSIVHCQP-UHFFFAOYSA-N 369.204 2.677 50 40 FFGB COC(=O)c1ccc(C(=O)[C@@H](Br)CBr)cc1 309350500 DADFXODQEKSILO-VIFPVBQESA-N 350.006 2.814 50 40 FFGB COCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1 408810072 LMWGUFSFTGKJAM-JLHYYAGUSA-N 355.350 2.833 50 40 FFGB CC(C)NC(=O)COc1ccc(/C=C(\C#N)C(=O)NC2CCCCC2)cc1 408787493 AWVPNRQQXSRTNA-SFQUDFHCSA-N 369.465 2.946 50 40 FFGB N#C/C(=C\c1ccccc1OCC(=O)O)C(=O)Nc1cccc([N+](=O)[O-])c1 408788999 GZBPOMAPJBKGHY-MDWZMJQESA-N 367.317 2.604 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)NCc2ccccc2OC)cc1 15162398 SRPWOVLXQPPGRQ-HYARGMPZSA-N 369.421 2.516 50 40 FFGB biogenic O=C(Cc1ccccc1)N/N=C/c1cc([N+](=O)[O-])c(O)c2ncccc12 59459156 CFLMYZXNUIFQMX-RGVLZGJSSA-N 350.334 2.541 50 40 FFGB O=C(NNC(=O)c1cc(Br)ccc1Cl)c1cccnc1 27634359 LFWCMRFWZQBSED-UHFFFAOYSA-N 354.591 2.572 50 40 FFGB CN(C)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)CSc1ccccc1 409003148 YHPYVDMSIFYRRT-WOJGMQOQSA-N 358.423 2.903 50 40 FFGB CCOC(=O)N1CCC(=NNC(=O)c2ccc(N(CC)CC)cc2)CC1 4863663 IBKNSHCTLFCTAL-UHFFFAOYSA-N 360.458 2.871 50 40 FFGB Cc1cc(C)nc(NNC(=O)CCCc2nc(-c3ccc(F)cc3)no2)n1 33240239 HQIULHIQCZLJTQ-UHFFFAOYSA-N 370.388 2.749 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)c(OC)c1 107578749 WLDPFMDJBKCRKX-UDWIEESQSA-N 356.378 2.629 50 40 FFGB COC(=O)COc1ccccc1/C=N/NC(=O)c1ccc(C)c(Cl)c1 409055010 OZUYAJWOZQTLHF-KEBDBYFISA-N 360.797 2.964 50 40 FFGB COc1cc2c(cc1/C=N/NC(=O)COc1cccc(Cl)c1)OCO2 409105325 MTDWLXRRVKUUJO-UFWORHAWSA-N 362.769 2.606 50 40 FFGB Cc1nn(-c2ccccc2)c2c1[C@]1(C(=O)Nc3ccccc31)C(N)=C(C#N)O2 585145623 GVYCXRICPOJPHE-NRFANRHFSA-N 369.384 2.505 50 40 FFGB NC(=O)[C@@H](Br)C12C[C@@H]3C[C@H](CC(Br)(C3)C1)C2 100091467 KARJLQXIQFBVED-JQIAMPCJSA-N 351.082 2.969 50 40 FFGB O=S1(=O)C[C@@H](Cl)[C@H](OC(Cl)(Cl)C(Cl)(Cl)Cl)C1 12175828 BADYEMQWKWXDSG-QWWZWVQMSA-N 370.896 2.909 50 40 FFGB Cc1ccc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1 101195240 GIADFOWGSIJLCB-WCQYUDONSA-N 350.212 2.505 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1c[nH]nc1-c1ccccc1 711109 HGJJZDKRIQIKHU-VXLYETTFSA-N 365.349 2.514 50 40 FFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1c1ccc([N+](=O)[O-])o1 999307 JDGBLHAEFVTTDT-ZDUSSCGKSA-N 351.274 2.512 50 40 FFGB O=C(COc1ccccc1)OC[C@H](Br)CBr 2045591 QFFFMOXFOFHBOX-SECBINFHSA-N 352.022 2.767 50 40 FFGB Cc1nn(-c2ccccc2)c(O)c1/C=N/NC(=O)c1ccccc1[N+](=O)[O-] 3211987 ZCHOZMZCFGQVOB-YBFXNURJSA-N 365.349 2.558 50 40 FFGB Cc1c(C(=O)NNC(=O)c2cc3ccccc3oc2=O)oc2ccccc12 15942457 QJAVBTNYMSBHIZ-UHFFFAOYSA-N 362.341 2.922 50 40 FFGB CCCCCOc1ccc(/C=N/NC(=O)C(=O)NCc2ccco2)cc1 17472309 NQWASOAQIQHXSR-FYJGNVAPSA-N 357.410 2.615 50 40 FFGB C/C(CC(=O)NCc1ccccc1)=N\NC(=O)c1cc(Cl)ccc1O 100090604 JKEUBPBMMWXZGA-CIAFOILYSA-N 359.813 2.858 50 40 FFGB COc1cc(OC)cc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1 2314234 FHMMGQVKHSQNMF-UHFFFAOYSA-N 366.373 2.637 50 40 FFGB CCOc1ccc(NC(=O)/C(C#N)=C\c2cc([N+](=O)[O-])c(O)cc2O)cc1 408742759 BYRHZJYXEXVHPH-GHXNOFRVSA-N 369.333 2.950 50 40 FFGB N#C/C(=C/N1CCN(c2ccc(F)cc2)CC1)S(=O)(=O)c1ccccc1 15412052 OBRWPYLPZLHXQE-CYVLTUHYSA-N 371.437 2.787 50 40 FFGB Cc1cc2c(c(=O)[nH]1)[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 18266084 YVHJWRQOGJCODU-ZDUSSCGKSA-N 358.195 2.664 50 40 FFGB CC(C)OC(=O)COc1ccc(/C=N/NC(=O)c2cccc(F)c2)cc1 6327971 CJLNGABHULEDKW-SRZZPIQSSA-N 358.369 2.920 50 40 FFGB Cc1ccc(NC(=O)CCC(=O)NNC(=O)Nc2ccccc2)cc1C 3261058 FLVGWAPMLOONQU-UHFFFAOYSA-N 354.410 2.875 50 40 FFGB COc1cccc(/C=N/NC(=O)c2cc(-c3ccccc3OC)n[nH]2)c1 9122950 DKQXXABLNRQFPP-UDWIEESQSA-N 350.378 2.858 50 40 FFGB COc1ccc2nc(/C=N/NC(=O)CCNC(=O)OC(C)(C)C)ccc2c1 5100314 NSCLWILFMWPFHY-CIAFOILYSA-N 372.425 2.608 50 40 FFGB Cn1cccc1C(=O)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 73407490 LVEDJGUPEUODMV-VXGBXAGGSA-N 351.328 2.609 50 40 FFGB COC(=O)c1ccccc1C(=O)[C@@H](Br)CBr 309509417 OCCVFUOTMRNFBW-VIFPVBQESA-N 350.006 2.814 50 40 FFGB CC1(C)[C@H](O)[C@@]2(Br)CC[C@]1(CC(=O)O)[C@@H]2Br 85398924 DRSFYJASRKYEEL-MPKXCIJOSA-N 356.054 2.539 50 40 FFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1cccs1 724173 HHCOHDZUMLLJFY-UHFFFAOYSA-N 369.240 2.659 50 40 FFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2Cl)ccc1O 7813071 MVDHRTMCEOZLOS-VXLYETTFSA-N 361.785 2.533 50 40 FFGB COc1cc(OC)cc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C(C)(C)C)c32)c1 9174757 XSFMMCAORJTELJ-CQSZACIVSA-N 354.410 2.943 50 40 FFGB COc1ccc(NCC(=O)N/N=C(/CCC(=O)O)c2cccs2)cc1 6027303 MREJTZYTFFDTFY-RGEXLXHISA-N 361.423 2.554 50 40 FFGB O=C(N/N=C/c1ccc([N+](=O)[O-])c(O)c1)c1ccccc1Br 34688804 ICTGKISQJRGAFB-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB C[C@@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCl 408738635 SWIBMCYWVIHRME-UKRRQHHQSA-N 370.877 2.840 50 40 FFGB CCc1ccc(N(CC(=O)N/N=C(\C)c2ccccc2)S(C)(=O)=O)cc1 409023460 ZKUMRNAYJOIULC-HMMYKYKNSA-N 373.478 2.555 50 40 FFGB O=C(O)[C@H](Br)[C@@H](Br)c1ccc([N+](=O)[O-])cc1 1737470 FZSNEPIHJADWSK-JGVFFNPUSA-N 352.966 2.879 50 40 FFGB in-vitro O=C(CCCC[C@H]1CCSS1)N[C@@H]1CCc2nnc(O)cc2C1 575610015 NNGHDYRYCZUFIQ-OLZOCXBDSA-N 353.513 2.870 50 40 FFGB COc1ccc(CC(=O)N/N=C(/C)c2ccc(OC)c(OC)c2)cc1OC 32561699 DIHNLBWFVBRXET-BKUYFWCQSA-N 372.421 2.804 50 40 FFGB O=C(CCn1ccc2ccccc21)NNC(=O)Cc1c[nH]c2ccccc12 24455955 GWLCHOAZWLRWJF-UHFFFAOYSA-N 360.417 2.903 50 40 FFGB COCCn1c(C)cc2c(c1=O)[C@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 2205277 BOGXZWSOJBJWCO-MRXNPFEDSA-N 371.824 2.675 50 40 FFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 59152806 WZBMHCCICVMNSA-RQZCQDPDSA-N 362.729 2.849 50 40 FFGB Cc1cc(C(=O)NN[C@H](C(=O)NC2CC2)c2ccccc2)c2ccccc2n1 15510611 WPKKNHBFMFZCNZ-FQEVSTJZSA-N 374.444 2.798 50 40 FFGB COc1cc(/C=C(/C#N)C(N)=O)ccc1OC(=O)c1ccccc1Cl 40161123 GCBVOPCTPNTKFN-WQLSENKSSA-N 356.765 2.960 50 40 FFGB Cc1ccccc1C(=O)N/N=C/c1ccc(I)o1 6217952 DSZUPOBKHMXCOB-OVCLIPMQSA-N 354.147 2.957 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc(OC)c1O 7384937 BNNRSFKMQBDWCH-FYJGNVAPSA-N 369.421 2.774 50 40 FFGB CCOc1ccc(N2C[C@H](C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2=O)cc1 7929187 QIUBSOMCBMQKBV-CYBMUJFWSA-N 370.361 2.952 50 40 FFGB C/C(=N\NC(=O)c1cccn1C)c1ccc(S(=O)(=O)C2CCCC2)cc1 46096449 SAZXEGBMVYXJJK-XSFVSMFZSA-N 373.478 2.895 50 40 FFGB O=C(N/N=C/c1cc(Br)c(O)c(Br)c1)C1CC1 3232422 RHBFNKIZGBUTMH-LHHJGKSTSA-N 362.021 2.777 50 40 FFGB COc1ccc(C(=O)NN/C=C2\C(=O)N(c3ccc(C)cc3)N=C2C)cc1 5447467 HVAQKENPKWHNDT-PDGQHHTCSA-N 364.405 2.545 50 40 FFGB O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)N/N=C/c1ccccc1 19362342 NLJCUZGZRPMWKJ-HYARGMPZSA-N 370.884 2.608 50 40 FFGB CCOC(=O)/C(C#N)=C/c1ccc(OCC(=O)N2CCCC2)c(OCC)c1 409173329 ILZKIBXZDYEBEO-LFIBNONCSA-N 372.421 2.557 50 40 FFGB COc1cccc(CC(=O)N/N=C\c2ccc(N3CCOCC3)cc2C)c1 409106570 OBHDZXVSNKCWAS-JCMHNJIXSA-N 367.449 2.533 50 40 FFGB COC(=O)Cn1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c2ccccc21 409224057 HGQSHGHRHHSKJU-JJFYIABZSA-N 367.380 2.646 50 40 FFGB CC1(C)[C@@H](O)[C@@]2(Br)CC[C@]1(CC(=O)O)[C@@H]2Br 85398925 DRSFYJASRKYEEL-GISOBZBCSA-N 356.054 2.539 50 40 FFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)COc2ccccc2C)cc1 4416374 LOIRQLSHAWEXDE-PXLXIMEGSA-N 369.421 2.903 50 40 FFGB COC(=O)COc1ccccc1/C=C(/C#N)C(=O)Nc1ccccc1F 408818412 OBQCRCKIJZUFKB-UVTDQMKNSA-N 354.337 2.923 50 40 FFGB C/C(CC(=O)Nc1cccc([N+](=O)[O-])c1)=N\NC(=O)c1cccc(C)c1O 5508974 QBQGCOMDWCPKBA-UDWIEESQSA-N 370.365 2.743 50 40 FFGB NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNc3cccc(Cl)c3)cc2)C1 53324256 AEMJDMTUUAGVNP-AWEZNQCLSA-N 372.856 2.799 50 40 FFGB CCOC(=O)NNC(=O)COc1cc2sc(C)nc2c2sccc12 43112629 JNPJLMUDQCYSBQ-UHFFFAOYSA-N 365.436 2.976 50 40 FFGB CCCc1nc2sc3c(c2c(=O)n1NC(=O)CCCl)CCCC3 2196795 XUJDJZIGYHRPJP-UHFFFAOYSA-N 353.875 2.988 50 40 FFGB Cc1ccc(NC(=O)/C(C#N)=C\c2cn(CC(N)=O)c3ccccc23)cc1 108064404 DWEJOJGYLFRYMF-GDNBJRDFSA-N 358.401 2.981 50 40 FFGB Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1ccccc1 7387360 KZVVGOPDSPAFMN-UHFFFAOYSA-N 373.459 2.742 50 40 FFGB CC(C)(C)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 9834641 VNAWYXPHJXMQJD-UHFFFAOYSA-N 373.906 2.548 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n(C)n1 59593988 PQNYFFBICIKVEM-UHFFFAOYSA-N 358.398 2.671 50 40 FFGB CCOP(=O)(CCC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)OCC 5711312 BJJTXUXBXLSTTH-RVDMUPIBSA-N 357.303 2.701 50 40 FFGB CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 1298201 FZEYGDSMNHIVPK-CYBMUJFWSA-N 371.393 2.948 50 40 FFGB O=C(NCCc1ccccc1)NNc1ccc(S(=O)(=O)C(F)F)cc1 58244320 BGJUOUHUUPZDHE-UHFFFAOYSA-N 369.393 2.552 50 40 FFGB CC(C)=CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 36312425 FRUUYFGSVULDCA-UHFFFAOYSA-N 361.405 2.662 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cc3ccccc3o2)c(C(=O)O)c1OC 2741439 GKRLHRFULHTFCZ-KEBDBYFISA-N 368.345 2.912 50 40 FFGB CC(C)(C)c1n[nH]c2c1[C@]1(C(=O)Nc3ccc(Cl)cc31)C(C#N)=C(N)O2 5095394 JUKAVYPHQWEJRO-GOSISDBHSA-N 369.812 2.685 50 40 FFGB Cc1ccc(-c2n[nH]c3c2[C@@]2(C(=O)Nc4ccccc42)C(C#N)=C(N)O3)cc1 5164040 VSAZDUXJBUUHFM-NRFANRHFSA-N 369.384 2.710 50 40 FFGB C[C@H]1C[C@@H]1c1ccc(/C=C/C(=O)NNC(=O)COc2ccccc2C#N)o1 16205095 XLCNPCJJVPQKJY-YIBPYUTOSA-N 365.389 2.514 50 40 FFGB Cc1ccc(NCC(=O)NNC(=S)NCCCc2ccccc2)cc1C 408586225 MPHFMNYFDLLTQU-UHFFFAOYSA-N 370.522 2.843 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)c2cccc(Cn3cccn3)c2)c1 1081714 CTAMNRBWRNSGKR-FYJGNVAPSA-N 364.405 2.713 50 40 FFGB CCn1c(SCC(=O)N/N=C/c2ccc(O)c(O)c2)nc2ccccc21 1477331 AUPMRKSRRMCWHH-VXLYETTFSA-N 370.434 2.710 50 40 FFGB COCC(=O)N/N=C(\C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl 100043602 GMLPJBBBWLJETE-DNTJNYDQSA-N 365.739 2.826 50 40 FFGB COc1ccccc1OCC(=O)N/N=C(\C)CC(=O)Nc1ccccc1F 100310685 VICPPYUCQFEXJA-LPYMAVHISA-N 373.384 2.734 50 40 FFGB CC(C)c1ccc(OCC(=O)NNc2nc(-c3ccncc3)no2)cc1 102158844 GFZCEVCUAZSLHG-UHFFFAOYSA-N 353.382 2.777 50 40 FFGB CCCCCn1nc(C(=O)NNC(=O)CCCC)c2ccccc2c1=O 12599540 GHFLUKQOOSQSAW-UHFFFAOYSA-N 358.442 2.538 50 40 FFGB C[C@H](Sc1nc2ccccc2s1)C(=O)NNC(=O)c1ccccc1O 95447644 PVKTZQRYVFNVCG-JTQLQIEISA-N 373.459 2.944 50 40 FFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 409053276 BRGXEPHRRRIFNF-QGMBQPNBSA-N 361.741 2.670 50 40 FFGB CCN(CC)c1ccc(/C=N\NC(=O)c2cc([N+](=O)[O-])ccc2O)cc1 34721089 YSWAXYUGZJTAHJ-UNOMPAQXSA-N 356.382 2.911 50 40 FFGB CC1(C)[C@H](O)[C@@]2(Br)CC[C@@]1(CC(=O)O)[C@@H]2Br 216528961 DRSFYJASRKYEEL-OINDSLJFSA-N 356.054 2.539 50 40 FFGB CC1(C)[C@@]2(CBr)CC[C@@]1(C(=O)O)[C@@H](Br)C2=O 169613676 MFQZVXXGEBQQQI-FZYJTZEISA-N 354.038 2.605 50 40 FFGB CCOC(=O)/C(C#N)=C/C=C(/c1ccc(Cl)cc1)N1CCN(C)CC1 19682208 IMNJYNGGVWMRNK-RRTUDWAXSA-N 359.857 2.941 50 40 FFGB CCc1c(C(=O)NNC(=O)c2cccnc2)cnn1-c1cccc(Cl)c1 24562441 IUEGUVLJGNNVIF-UHFFFAOYSA-N 369.812 2.558 50 40 FFGB O=C(/C=C/c1cccc2ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1 10369141 JHQRJEBIHGHBIO-SJFMBGHLSA-N 374.396 2.840 50 40 FFGB O=C(NNC(=O)c1cc(Br)ccc1Cl)c1ccncc1 2645927 GNWSGRYTXPONHX-UHFFFAOYSA-N 354.591 2.572 50 40 FFGB CCN(CC)c1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)c(O)c1 3527169 JXNQIWOHLPGYPI-MRUVXERFSA-N 369.421 2.529 50 40 FFGB COc1cccc2cc(/C(N)=N/NC(=O)c3cccc(Cl)c3)c(=O)oc12 32601309 WRDLYHZAKIYIMK-UHFFFAOYSA-N 371.780 2.505 50 40 FFGB CC1(C)[C@H](O)[C@@]2(Br)CC[C@]1(CC(=O)O)[C@H]2Br 225516229 DRSFYJASRKYEEL-YKDSUIRESA-N 356.054 2.539 50 40 FFGB OC[C@H](I)CC(F)(F)C(F)(F)Br 80440343 NAXMYDUMZNNYCA-GSVOUGTGSA-N 364.902 2.795 50 40 FFGB C/C(=N\NC(=O)CN(c1ccccc1C)S(C)(=O)=O)c1ccc(C)cc1 19954738 GJRNSLQFNJRJJH-CAPFRKAQSA-N 373.478 2.610 50 40 FFGB CCc1nnsc1C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C 24396338 OTHRIPQWJBBVAU-UHFFFAOYSA-N 373.463 2.607 50 40 FFGB COc1ccccc1[C@H]1C(C#N)=C(N)N(N(C)C)C2=C1C(=O)CC(C)(C)C2 1010329 KQGJWBCOLPSOAU-SFHVURJKSA-N 366.465 2.908 50 40 FFGB COC(=O)CC1=C(C(=O)OC)[C@@H](c2ccc(C(C)C)cc2)C(C#N)=C(N)O1 4476295 QGCFPEMAUCOYOH-KRWDZBQOSA-N 370.405 2.608 50 40 FFGB COc1cccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1 2291373 CUYGYNXCBKWOBD-FVUPAENESA-N 371.824 2.852 50 40 FFGB O=C(CSc1ccccc1F)NNC(=O)NCCc1ccc(F)cc1 12979052 KPOKEIVIDYEGGA-UHFFFAOYSA-N 365.405 2.630 50 40 FFGB COc1ccc(CC(=O)NNC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1 4679598 MYIMWBGNGFOWME-UHFFFAOYSA-N 357.797 2.834 50 40 FFGB COc1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1Br 28699960 LGHZQAYUOWUKTO-BWODNOAJSA-N 365.227 2.660 50 40 FFGB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1 4729473 XQCBUEOBLUJVME-ZJJGVRJWSA-N 351.362 2.559 50 40 FFGB Cc1ccc(C(=O)N/N=C\c2ccc(SCCO)c([N+](=O)[O-])c2)cc1 32124812 FXHHGLNNYGSWOJ-WQRHYEAKSA-N 359.407 2.752 50 40 FFGB O=C1c2ccc(I)c(F)c2O[C@H]1Br 98210850 KPJLRAWYPIGUOA-MRVPVSSYSA-N 356.916 2.726 50 40 FFGB O=C(COc1ccc(Cl)cc1)N/N=C1\C(=O)Nc2ccc(Cl)cc21 6058759 XZKQORBFMOYKOC-UHFFFAOYSA-N 364.188 2.845 50 40 FFGB Cn1cc(C(=O)N/N=C/C(Br)=C\c2ccccc2)ccc1=O 4469537 PRSQVYWGYRCJLE-FCJXZZIYSA-N 360.211 2.537 50 40 FFGB CCN(CC)c1ccc(C(=O)N/N=C/c2ccccc2OCC(=O)O)cc1 3213164 XXDQRJRSCBPLTG-FYJGNVAPSA-N 369.421 2.760 50 40 FFGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 59515241 JMZULDMEGUCYRO-KEBDBYFISA-N 353.378 2.774 50 40 FFGB O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)c1ccccc1F 12600222 SXONOENNAVKGBE-UHFFFAOYSA-N 355.394 2.953 50 40 FFGB O=C(N/N=C/c1ccccc1F)C(=O)Nc1ccccc1Br 59435806 VSCDEOFRBDRSID-GIJQJNRQSA-N 364.174 2.677 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)N2CCCCC2)c(C)n1-c1ccc(F)cc1 408969780 UJZXUZSXOUGELZ-LPYMAVHISA-N 370.428 2.696 50 40 FFGB Cc1ccc2c(c1)S[C@H](C(=O)NNc1nc(-c3ccncc3)no1)C2 1251577189 ONEUQCFIYHJMLN-AWEZNQCLSA-N 353.407 2.600 50 40 FFGB COc1ccc([C@@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)cc1 12275724 QDPNVWXVENURPF-LIRRHRJNSA-N 368.414 2.931 50 40 FFGB CC1(C)CC(=O)C2=C(C1)NC(SCC(N)=O)=C(C#N)[C@H]2c1ccco1 12250529 PRFCYAYGORCCPG-HNNXBMFYSA-N 357.435 2.563 50 40 FFGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C(=O)NCCCc1ccccc1 409236188 RWOHGKYROMVWPP-WJDWOHSUSA-N 351.362 2.956 50 40 FFGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccccc1OC 15423059 DVNKTXFIJQXZSY-LLVKDONJSA-N 357.248 2.704 50 40 FFGB COc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)OC(C)C)cc2)cc1 6327967 ATDHKUZDVZMURY-CIAFOILYSA-N 370.405 2.790 50 40 FFGB CC(=O)c1c(NNC(=O)COc2ccc(C(C)(C)C)cc2)oc(C)cc1=O 1438912 UKGKCMFJTCBOOT-UHFFFAOYSA-N 372.421 2.970 50 40 FFGB O=C(NN1C(=O)[C@@H](Cl)[C@@H]1c1cccc(Cl)c1)c1ccccc1O 1633516 GVALIQHSELKKKI-KBPBESRZSA-N 351.189 2.881 50 40 FFGB CC1=C(C)C[C@H](C(=O)NNC(=O)c2cccc(Cl)c2)[C@@H](C(=O)O)C1 5044982 YESXGRJZKOEVKU-KBPBESRZSA-N 350.802 2.548 50 40 FFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c2C)c1 408968867 CICSRVRWHQVCLD-WSDLNYQXSA-N 354.454 2.625 50 40 FFGB NC(=O)N/N=C/c1ccc(-c2ccc(Br)cc2[N+](=O)[O-])o1 6224405 WNAVPPRQYVWBSZ-GIDUJCDVSA-N 353.132 2.620 50 40 FFGB O=Cc1cc(OC(=O)Oc2ccc([N+](=O)[O-])c(C=O)c2)ccc1[N+](=O)[O-] 1566895 INHTXSSKGFPEAM-UHFFFAOYSA-N 360.234 2.706 50 40 FFGB O=C(NNC(=S)NC1CCCCC1)c1ccccc1Br 2312812 CPBDXXFUBZMBRS-UHFFFAOYSA-N 356.289 2.891 50 40 FFGB CN(C)c1nc(N)nc(/C(C#N)=C\C2=Cc3cc(Cl)ccc3OC2)n1 48520759 MTSUJKUVKHSNSH-SDQBBNPISA-N 354.801 2.556 50 40 FFGB CC(C)(C)c1ccc(C(=O)N/N=C/c2ccc(S(=O)(=O)O)o2)cc1 4508849 CFODDCFAFOBHKQ-LICLKQGHSA-N 350.396 2.588 50 40 FFGB COc1ccc(N[C@@H](C)C(=O)N/N=C(/C)c2ccc([N+](=O)[O-])cc2)cc1 4619325 MCZJXCZTDMPGGW-RQZLXBNYSA-N 356.382 2.944 50 40 FFGB N#C/C(=C/c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(C(=O)O)c1 408544470 UAMQFHLSUJYQMF-ZSOIEALJSA-N 350.330 2.702 50 40 FFGB COc1ccc(/C=N/NC(=O)c2cccnc2)cc1COc1ccccn1 8632539 NDKYFCXBUFCSCQ-FSJBWODESA-N 362.389 2.828 50 40 FFGB FC(F)(F)C1(C(F)(F)F)[C@H]2C[C@@H]3[C@@H]([C@H]2I)N31 100122210 DTKNYSHMNMVGAO-SHSKGQOXSA-N 357.035 2.740 50 40 FFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C/c2ccc(SC)cc2)c1 5720316 LAOKMNRDQUJYOX-YBFXNURJSA-N 373.434 2.515 50 40 FFGB O=C1O[C@H]2[C@@H]3C[C@@H]([C@H]2Br)[C@H](C(=O)Nc2cccc(Cl)c2)[C@@H]13 102615317 IFAQTGVULZCIDC-QXMWZZNTSA-N 370.630 2.850 50 40 FFGB O=S(=O)(Cc1ccccc1)C[C@H](Br)CBr 1758092 BWGFANVMJTUWDD-SNVBAGLBSA-N 356.079 2.760 50 40 FFGB COc1ccc(Cl)cc1/C=N/NC(=O)COc1ccccc1[N+](=O)[O-] 1434020 IDABYXNFAPMCSY-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB O=C(CCC(=O)Nc1ccccc1Cl)NNC(=O)C1CCCCC1 2134748 MEKBXIYQQRZPBL-UHFFFAOYSA-N 351.834 2.786 50 40 FFGB COc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1sccc1C 59434274 VXYQWOCKKGSXSZ-CAOOACKPSA-N 351.815 2.807 50 40 FFGB C[C@H]1CN(C(=O)NNC(=O)c2ccc(F)cc2)C[C@H](c2ccccc2)O1 67874500 AUCXPYSMWZKHPX-SUMWQHHRSA-N 357.385 2.642 50 40 FFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccccc2C)c1C 408946621 ZBNHQDQBDIHKPD-STCDJXRXSA-N 354.454 2.767 50 40 FFGB O=C(CCNC(=O)c1ccc(F)cc1F)Oc1ccc([N+](=O)[O-])cc1 102867774 SHDZKKSGRLACPM-UHFFFAOYSA-N 350.277 2.599 50 40 FFGB COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1[N+](=O)[O-] 3106958 DMJTWYNIFKRGGS-GIJQJNRQSA-N 363.757 2.786 50 40 FFGB CCOc1cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)ccc1OC 6960397 JAYFOSDQBIOYIU-VXLYETTFSA-N 374.466 2.743 50 40 FFGB COc1ccc(-c2n[nH]cc2/C=N/NC(=O)c2ccccc2)c(OC)c1 4613341 TXFNUNLREOIEMS-CIAFOILYSA-N 350.378 2.858 50 40 FFGB O=C(NNC(=S)NCc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2o1 408587207 SIXQSRREEFGFDH-UHFFFAOYSA-N 370.390 2.650 50 40 FFGB CCCOc1cc(OC)ccc1[C@H]1C(C#N)=C(N)Oc2oc(C)cc(=O)c21 5793603 MFYZGXCNOXFYLM-KRWDZBQOSA-N 368.389 2.964 50 40 FFGB COc1ccc(OC)c(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)c1 1259090 DNWVCLJJNGUCIP-VXLYETTFSA-N 370.434 2.823 50 40 FFGB C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NN=C1CCCCCC1 6176038 PTPUWXCXEVZVHR-GFCCVEGCSA-N 371.890 2.833 50 40 FFGB C/C(=N\NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O)C(C)(C)C 408915374 ZXZPBFPCFVYEOL-NBVRZTHBSA-N 353.488 2.608 50 40 FFGB COc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2O)cc1 6469536 LVTLDPOPVXWHDW-UDWIEESQSA-N 350.378 2.659 50 40 FFGB COc1ccc(-c2nc(Nc3ccccn3)sc2CCC(=O)NN)cc1 4562165 PTVGYFUNMIYLKP-UHFFFAOYSA-N 369.450 2.880 50 40 FFGB Cc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 409068367 FZHFLOWBRKNCAZ-DEDYPNTBSA-N 368.393 2.504 50 40 FFGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(N2CCOCC2)o1 409001213 VMHXQSFKNRLODC-OOWUWCJESA-N 373.478 2.888 50 40 FFGB O=C(N/N=C/c1cc(Br)c(Br)o1)c1ccncc1 1092699 XIQNODKKEBEUIM-GIDUJCDVSA-N 373.004 2.964 50 40 FFGB CCc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 8083896 XGLYLWXJHDZYSZ-LTNVFZTJSA-N 353.397 2.891 50 40 FFGB N#CC1=C(SCC(=O)N2CCCCC2)NC(=O)C[C@@H]1c1ccccc1 6496138 BFIIIRYTFMULDB-OAHLLOKOSA-N 355.463 2.771 50 40 FFGB O=C(N/N=C/c1cc(Cl)cc(Br)c1O)c1ccncc1 2324310 JMZSUWQIHAPZAR-REZTVBANSA-N 354.591 2.967 50 40 FFGB C/C(=C\C(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1ccccn1 101456480 NZZFVYIPGZXGCF-VOTSOKGWSA-N 373.228 2.622 50 40 FFGB O=C(CC1(C(=O)O)CCCCCC1)NNC(=O)c1ccccc1Cl 8393909 DSTSHVRIHFLHKN-UHFFFAOYSA-N 352.818 2.916 50 40 FFGB Cc1ccc(C(=O)NNC(=O)COc2cccc3c2OC(C)(C)C3)cc1 5853410 IAYWMHCNFJXVMO-UHFFFAOYSA-N 354.406 2.549 50 40 FFGB Cc1ccc(C(=O)N[C@]2(C(Cl)Cl)C(=O)N=C3SC=CN32)cc1 101411133 QBQMGWUJNUCXIT-AWEZNQCLSA-N 356.234 2.641 50 40 FFGB CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)c3ccc[n+]([O-])c3)cc2C1 8393555 SDSSQKMCNTVSKI-CQSZACIVSA-N 373.478 2.607 50 40 FFGB O=C(CC(=O)N/N=C\c1ccc(Br)cc1)NCc1ccccc1 59444813 NGMVYNNOBVVIOJ-NDENLUEZSA-N 374.238 2.606 50 40 FFGB Cc1noc(C)c1COc1ccc(C(=O)NNC(=O)c2ccoc2C)cc1 5823783 AFBNYFYYJFEPKH-UHFFFAOYSA-N 369.377 2.847 50 40 FFGB Cc1nc2ccccc2n1CC(=O)NNC(=O)/C=C/c1ccc(Cl)cc1 40049168 UBUGWCDVHWVBCV-DHZHZOJOSA-N 368.824 2.859 50 40 FFGB CCc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC)cc1 2424227 AZUABUIHRRLFOB-NTCAYCPXSA-N 374.400 2.702 50 40 FFGB O=C(NNC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1cccnc1 17441133 VCSIOOCPWHYHRX-UHFFFAOYSA-N 369.384 2.767 50 40 FFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccccc1 408603820 HIXZWTXEQWMAPX-MRXNPFEDSA-N 367.478 2.940 50 40 FFGB C/C(=N\NC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O)C(C)(C)C 408777613 DFBDWOCGQGRWBV-NBVRZTHBSA-N 353.488 2.608 50 40 FFGB CCOc1ccc(N[C@@H]2SC(=O)N(CCBr)C2=O)cc1 36626559 MRZVBULIXQREBN-LLVKDONJSA-N 359.245 2.914 50 40 FFGB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N/N=C/C1=Cc2ccccc2OC1 5100552 AKYCXTNVJLTLCJ-GKXUUXLPSA-N 371.437 2.964 50 40 FFGB CCOc1ccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccccc2)cc1 14084866 JBRJLWCNYVVNKC-UHFFFAOYSA-N 350.378 2.550 50 40 FFGB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2 108340588 YAUXVDZNVZLBLS-RISOHXOYSA-N 373.453 2.617 50 40 FFGB O=C(NNC(=O)c1cccc(Cl)c1)c1ccc(N2CCCC2=O)cc1 3396490 DPPCGJTZSRTZQF-UHFFFAOYSA-N 357.797 2.542 50 40 FFGB O=C(Cn1c(-c2ccccc2Cl)nc2ccccc21)NNC(=O)C1CC1 15663299 UXAUZVTUXVFZIY-UHFFFAOYSA-N 368.824 2.914 50 40 FFGB C/C(=N/NC(=O)COc1ccccc1)c1ccc(NC(=O)C2CC2)cc1 17072871 YINHKOHPNXIYRW-HMAPJEAMSA-N 351.406 2.954 50 40 FFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(N2CCCC2)cc1 33778150 HHGDIMXZPPGOAA-ZHZULCJRSA-N 352.394 2.888 50 40 FFGB O=C(COc1cccc(F)c1)NNC(=O)c1cc(Cl)ccc1Cl 12784903 LVGCUTZVXWASSA-UHFFFAOYSA-N 357.168 2.973 50 40 FFGB N#C/C(=C\N1CCN(c2ccccc2)CC1)C(=O)NCCc1ccccc1 5485404 OLOIMLMWDNCTLN-CZIZESTLSA-N 360.461 2.575 50 40 FFGB O=C(COc1cccc(Cl)c1)N/N=C\c1ccc(N2CCOCC2)cc1 409107475 VXZGWHPMNLCIJK-BKUYFWCQSA-N 373.840 2.706 50 40 FFGB CC(=O)O[C@]12[C@H](Br)[C@@H]3[C@@H]4[C@@H]5C[C@H]3[C@@H]1[C@@H]5[C@@H](Br)[C@H]42 245232066 OWYYCXRWCMJAHL-ICGKXMPCSA-N 362.061 2.587 50 40 FFGB CC(C)(C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 5379624 WAIJBBOOICEICJ-FYJGNVAPSA-N 353.422 2.630 50 40 FFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCCc1cccs1 6402871 BTCZFLZCMUTPMD-LBPRGKRZSA-N 350.415 2.825 50 40 FFGB COCCCNC(=O)/C(C#N)=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 6579790 VUKLGXLTLPNQBW-SDNWHVSQSA-N 355.350 2.914 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2)c1 59501681 ZSPYGZSIVKYYBJ-UDWIEESQSA-N 357.797 2.994 50 40 FFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(OC)cc3)CC2=O)cc1 409249953 KHVNKNJPQQLMOT-RIWZNOJBSA-N 365.433 2.761 50 40 FFGB O=C(NNc1ncnc2c1cnn2-c1ccc(F)cc1)c1cccs1 13496867 PRHBZXKPTNQHLI-UHFFFAOYSA-N 354.370 2.773 50 40 FFGB O=C(CCl)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 3885232 GDJSMJJAGQWDKW-UHFFFAOYSA-N 351.255 2.692 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)CSc2ccc(C)cc2)cc1 14186029 OSWBLGIWMFPONW-RGVLZGJSSA-N 372.446 2.789 50 40 FFGB Nc1ccccc1C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1 409004613 ATZAUZHGXMSGFD-UDWIEESQSA-N 353.382 2.541 50 40 FFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)cc2)cc1 4680006 FBYGZYMPZACIFA-GXDHUFHOSA-N 352.346 2.704 50 40 FFGB NNC(=O)c1cc([N+](=O)[O-])ccc1OCc1ccc(Br)cc1 226329416 ZLLAADSEPAAEFC-UHFFFAOYSA-N 366.171 2.540 50 40 FFGB O=C(NNC(=O)c1ccccc1OC[C@H]1CCCO1)c1ccc(Cl)cc1 22458073 BMQSRGWLKPXNJP-OAHLLOKOSA-N 374.824 2.973 50 40 FFGB Cc1occc1C(=O)NNC(=O)c1ccc(NC(=O)c2ccco2)cc1 8191333 DRPYAEPFJLVYLH-UHFFFAOYSA-N 353.334 2.508 50 40 FFGB C[C@@H](OC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1)C(=O)NCc1ccco1 97673955 GYFDMPUSXUGRGN-VQCBNXJZSA-N 367.405 2.501 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)c2c(C)nc3ccccn23)cc1OC 7041686 CVEBFWOFKVVVQK-FYJGNVAPSA-N 364.405 2.980 50 40 FFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])o1)CO2 1743502 ZEHOUGILTBBWID-VTNJTDAWSA-N 373.365 2.775 50 40 FFGB O=C(NNc1ccc(F)cc1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 40069337 UMWSAYNQNOFLBR-OAHLLOKOSA-N 353.397 2.811 50 40 FFGB COc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)NCc2ccncc2)cc1 656736 QQKOELSBLGWONM-MHWRWJLKSA-N 359.389 2.704 50 40 FFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1Br 818663 UEFJCLVXKIUFFN-CYBMUJFWSA-N 361.199 2.707 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)CSc1ccccc1 6611191 DLGGPSZRRSFUME-UHFFFAOYSA-N 364.854 2.967 50 40 FFGB CCN(NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21)c1ccc(C)cc1 26075283 PZBJZYQGMCVMGD-OAHLLOKOSA-N 353.422 2.667 50 40 FFGB O=C(N/N=C/c1cccs1)C(=O)Nc1ccccc1Br 59435832 ZFINCKOGZNFZRY-OVCLIPMQSA-N 352.213 2.599 50 40 FFGB Cc1ccn2cc(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)nc2c1 15762293 SYXALWLSVFXXBP-NSHDSACASA-N 368.462 2.904 50 40 FFGB CCc1cc2c(=O)n(CC(=O)N/N=C\C=C\c3ccccc3)cnc2s1 16872845 LHJQERYCUSMUSC-VMGASSTCSA-N 366.446 2.836 50 40 FFGB CC(C)CC(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 15895490 BCGLDPZROITRCV-UHFFFAOYSA-N 351.406 2.798 50 40 FFGB O=C(C(Cl)Cl)N1CCN(C(=O)C(Cl)Cl)c2ccccc21 1562186 VWCLKJUFZYYLSW-UHFFFAOYSA-N 356.036 2.974 50 40 FFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(Br)o2)c1 107736261 BYUGQXGCICFIJL-LZYBPNLTSA-N 350.172 2.764 50 40 FFGB Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)[C@@H]2CCCO2)c(C)n1C[C@H]1CCCO1 27896675 QHNLAJWXCNLXGR-HYHCEMAZSA-N 371.481 2.875 50 40 FFGB CCOc1cc(/C=N/NC(=O)c2ccccc2C)ccc1OCC(=O)OC 9202117 YDTCLUJJRHKVMP-CIAFOILYSA-N 370.405 2.709 50 40 FFGB Cn1c(C(=O)NNC(=O)c2ccco2)c(Br)c2ccccc21 48277599 FGFDWRQXEGGCCG-UHFFFAOYSA-N 362.183 2.609 50 40 FFGB COCC1=C(C(=O)OC)[C@@H](c2cccc3ccccc23)C(C#N)=C(N)O1 4189183 YDEOCHPWIMGSML-KRWDZBQOSA-N 350.374 2.721 50 40 FFGB O=C(NNC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)[C@@H]1CCCO1 72009423 SKERKCBMOPMQLZ-NFAWXSAZSA-N 371.462 2.673 50 40 FFGB CCOc1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc([N+](=O)[O-])c1O 409369967 ILWJPFYIPQNPGV-AWNIVKPZSA-N 356.338 2.760 50 40 FFGB C=CCN1C(=O)/C(=N\NC(=O)COc2ccc(Cl)cc2)c2ccccc21 5175631 LURWYHYOGSTCAJ-PYCFMQQDSA-N 369.808 2.772 50 40 FFGB O=C(NNS(=O)(=O)c1ccccc1Cl)C12CC3CC(CC(C3)C1)C2 5127168 JZKRYEDQEBUZKN-UHFFFAOYSA-N 368.886 2.866 50 40 FFGB CC(C)NC(=C(C#N)C#N)[C@@]1(C#N)[C@H](c2cccc([N+](=O)[O-])c2)C1(C#N)C#N 78547417 BEFGDEWGNRZEOL-VQIMIIECSA-N 371.360 2.535 50 40 FFGB Cc1sc2ncnc(SCC(=O)NNC(=O)c3ccccc3)c2c1C 3604193 YLDFAKHTTRPWKL-UHFFFAOYSA-N 372.475 2.861 50 40 FFGB COc1cc(/C=C(\C#N)C(=O)Nn2c(C)ccc2C)c([N+](=O)[O-])cc1OC 409370422 QNWPRRKJRLHFOY-VGOFMYFVSA-N 370.365 2.708 50 40 FFGB CCc1sc(/C=N/NC(=O)COc2ccc(F)cc2)cc1[N+](=O)[O-] 1085496 GEMVMWCNJOPQJV-CAOOACKPSA-N 351.359 2.887 50 40 FFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccccc3F)[C@@H]2C1 4123649 OBIHWBOODSBNFV-MJGOQNOKSA-N 361.424 2.961 50 40 FFGB O=C(Cn1nc(C(F)F)cc1C(F)F)N/N=C/c1ccc2c(c1)OCO2 652351 ZZOJYPSXAIOUPM-DENHBWNVSA-N 372.278 2.637 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)NC(C)C)c(C)n1-c1cccc(Cl)c1 4091308 DUTWPCIMKUDSOC-KEBDBYFISA-N 360.845 2.722 50 40 FFGB CC(=O)N1CCC(=NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 4866943 YHTVERKRTHOKCY-UHFFFAOYSA-N 352.438 2.822 50 40 FFGB Cn1cccc1C(=O)NNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 73407496 LVEDJGUPEUODMV-NWDGAFQWSA-N 351.328 2.609 50 40 FFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1 408795306 LLVVZWTUQYICQP-RVDMUPIBSA-N 366.373 2.880 50 40 FFGB Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 4359447 PGNLUPVEMXSNFC-GIJQJNRQSA-N 360.757 2.645 50 40 FFGB COc1cc(/C=N/NC(=O)[C@H](C)n2nnc3ccccc32)cc(Cl)c1O 1103474 FYNUOOJGCCFBDP-XPAGJJBOSA-N 373.800 2.510 50 40 FFGB Cc1c(NC(=O)/C(C#N)=C/c2ccccc2O)c(=O)n(-c2ccccc2)n1C 1453574 IULGPWUSUWETLY-FOWTUZBSSA-N 374.400 2.736 50 40 FFGB CCOc1ccc(-c2cc(C(=O)N/N=C/c3cccnc3)[nH]n2)cc1OC 1814700 LGKPMFWUPYOGCM-CIAFOILYSA-N 365.393 2.643 50 40 FFGB C=CCc1cc(/C=N/NC(=O)c2cccs2)cc(OC)c1OCC(=O)O 5879745 URGSZWUWMZMYBD-VXLYETTFSA-N 374.418 2.713 50 40 FFGB O=C(COc1ccc(F)cc1)N/N=C/c1cc(Br)ccc1O 3532489 NMELMPRDUXEJBP-QGMBQPNBSA-N 367.174 2.823 50 40 FFGB Cc1cc(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)nc(Cl)n1 2559292 KIYSORJNVCJQOV-UHFFFAOYSA-N 358.707 2.532 50 40 FFGB O=C(CSc1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Cl)cc1 6053866 OUTZDPFXCKURKH-UHFFFAOYSA-N 365.798 2.802 50 40 FFGB COc1cc(NC(=O)C/C(C)=N/NC(=O)C(C)C)c(OC)cc1Cl 4697792 OVGRAAZPDIARAZ-VXLYETTFSA-N 355.822 2.834 50 40 FFGB CN(CCO)c1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 24035884 KGBXGZUCZBDJIE-HYARGMPZSA-N 363.417 2.738 50 40 FFGB COc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 409004677 BEJJJKFEVQUAFA-DEDYPNTBSA-N 368.393 2.968 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2ccc(OC3CSC3)cc2)cc1 408732646 XAFZJVOQNHJPID-KEBDBYFISA-N 372.446 2.719 50 40 FFGB COc1ccc(CSCC(=O)N/N=C/c2ccc(OCC#N)cc2)cc1 408837525 HRYWGOBHGZAQFR-CIAFOILYSA-N 369.446 2.981 50 40 FFGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 8558489 WDRKCHPNAAHMFM-YBFXNURJSA-N 354.366 2.953 50 40 FFGB COc1ccc(Cl)cc1C(=O)NNC(=O)Cc1c[nH]c2ccccc12 2628516 VLZNRWVUZGGDHW-UHFFFAOYSA-N 357.797 2.834 50 40 FFGB COC(=O)[C@]12CC[C@@](CBr)(C(=O)[C@H]1Br)C2(C)C 100931625 PVYFESIMHVMBHV-HFKOZYHYSA-N 368.065 2.693 50 40 FFGB CCCn1nc(C(=O)N/N=C/c2ccc(OC)cc2)c2ccccc2c1=O 6652254 BWAGUGZMRVVNCT-FYJGNVAPSA-N 364.405 2.579 50 40 FFGB C=CCc1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc(OC)c1O 4715688 YRQZALGPXVOQGQ-SSDVNMTOSA-N 353.353 2.904 50 40 FFGB Nc1ccccc1C(=O)N/N=C/c1ccccc1I 408729434 ZUFUINXEOPWINZ-RQZCQDPDSA-N 365.174 2.637 50 40 FFGB O=C(N/N=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1ccncc1 30814084 PPFQITZIRZOWGS-NHDPSOOVSA-N 363.333 2.941 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(C)nc2)cc(Br)c1O 918931 DVITVHBXSYRAKR-CNHKJKLMSA-N 364.199 2.631 50 40 FFGB CC(C)c1n[nH]c2c1[C@@]1(C(=O)Nc3ccc(Cl)cc31)C(C#N)=C(N)O2 9009096 YOEXACYXZFKODF-KRWDZBQOSA-N 355.785 2.511 50 40 FFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@@H](c1ccccc1)C(C#N)=C(N)O2 2258129 RXXVCDUJUZJSCT-YJBOKZPZSA-N 363.417 2.554 50 40 FFGB COc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])c(OC)c1C 107721995 BHFGGTGRKQXPKC-ODLFYWEKSA-N 357.366 2.613 50 40 FFGB O=C1Nc2ccc(Br)cc2/C1=N/NC(=O)c1cccc(F)c1 6251164 AOIVLHVJFWWMLK-UHFFFAOYSA-N 362.158 2.674 50 40 FFGB O=C(N/N=C/c1ccccc1F)C1CCN(C(=O)c2ccccc2)CC1 409007204 VGOBLBFAOQSFAR-HYARGMPZSA-N 353.397 2.828 50 40 FFGB COc1ccc(CC(=O)N/N=C\c2ccc(N3CCOCC3)cc2C)cc1 409075484 WEAHNLCTAKSSSA-JCMHNJIXSA-N 367.449 2.533 50 40 FFGB COc1cc(/C=C(/C#N)c2cccc([N+](=O)[O-])c2)ccc1OCC(N)=O 33803387 UNPPBBGFLFAVES-AUWJEWJLSA-N 353.334 2.532 50 40 FFGB COC[C@H](Cl)/C(N)=N/S(=O)(=O)c1c(C)cc(Cl)cc1Cl 2148764 VYZGISWRCPMPFS-VIFPVBQESA-N 359.662 2.602 50 40 FFGB CC(=O)O[C@@]12[C@@H]3[C@@H]4[C@H]5C[C@@H]3[C@H]([C@H]5[C@H]1[C@H]4Br)[C@@H]2Br 100500315 OWYYCXRWCMJAHL-XBRMUGENSA-N 362.061 2.587 50 40 FFGB CC[C@@H](Oc1ccc(C)cc1)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 12137413 GWWXLCHTABPBNI-MRXNPFEDSA-N 357.366 2.522 50 40 FFGB COc1ccccc1OCC(=O)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 34967440 AXCMBYXVEJCKRD-NVMNQCDNSA-N 363.757 2.786 50 40 FFGB CC(C)(C)C(=O)Nc1ccc(C(=O)NNC(=O)Cc2ccccc2)cc1 726379 ZZFMOZGFYCUJFO-UHFFFAOYSA-N 353.422 2.675 50 40 FFGB N#C/C(N)=C(C#N)/N=C/c1cc(Br)c(O)c(Br)c1 3135551 KYXWRVKZEZLYAW-SYSGVOERSA-N 370.004 2.554 50 40 FFGB COc1ccccc1C(=O)N/N=C/c1c(C)nn(-c2ccccc2)c1O 5576111 SBSHKMXYOOAXOH-UDWIEESQSA-N 350.378 2.659 50 40 FFGB Cc1ccc(NNC(=O)c2ccc(=O)n(-c3ccccc3)n2)cc1Cl 24971300 TUECZZBXRAYGAV-UHFFFAOYSA-N 354.797 2.951 50 40 FFGB CCOC(=O)OC(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F 575629048 PFUTWHSXZMRCPB-SNVBAGLBSA-N 351.346 2.969 50 40 FFGB CCCCC(=O)NNC(=O)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839326 FHHXUQOBRPSXEV-UHFFFAOYSA-N 361.829 2.501 50 40 FFGB CCn1c(NNC(=O)/C=C/c2ccc(F)cc2)nc2ccccc2c1=O 32904537 ZBCKREBUSGYABL-FMIVXFBMSA-N 352.369 2.712 50 40 FFGB Cc1cccc(OCC(=O)NNC(=O)CCSc2ccc(F)cc2)c1 12680298 VNMWWUZUJUKBII-UHFFFAOYSA-N 362.426 2.843 50 40 FFGB Cc1cccc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(N)=O)c1C 4205677 LCFPVXWTUNBEJW-XNTDXEJSSA-N 374.400 2.804 50 40 FFGB O=C(N/N=C/c1ccc2c(c1)OCCO2)c1ccccc1Br 903788 JMNGWZLVIZEQAI-VCHYOVAHSA-N 361.195 2.984 50 40 FFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)Cc1cccc(F)c1 14112053 XKGMAVOWMHCETG-UHFFFAOYSA-N 350.777 2.556 50 40 FFGB C=CCn1c(SCC(=O)/C(C#N)=C(/C)N)nc2sc(C)c(C)c2c1=O 104789310 SOTBKHGSGCPSTL-BENRWUELSA-N 374.491 2.678 50 40 FFGB CCN1C(=O)/C(=N\NC(=O)c2ccc(OC)c(OC)c2)c2cc(C)ccc21 6497183 GJTHUJFFJMXTDY-UZYVYHOESA-N 367.405 2.513 50 40 FFGB CCOc1cc([N+](=O)[O-])cc(/C=N\NC(=O)Cc2ccc(F)cc2)c1O 409239677 DBAQAPHOCPAPAY-GRSHGNNSSA-N 361.329 2.531 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 409263965 DFGRWRRKTAQAIJ-FEMWLQECSA-N 365.433 2.979 50 40 FFGB N#C/C(=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)C(=O)Nc1ccccc1F 408811909 AULQGMJSMLWQGX-YHYXMXQVSA-N 372.268 2.893 50 40 FFGB COc1cc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc([N+](=O)[O-])c1O 409363485 LZLHOKFPDPDHOO-GRSHGNNSSA-N 357.366 2.619 50 40 FFGB Cc1occc1C(=O)NNC(=O)c1ccc(COCC(F)(F)F)cc1 22319264 SGNKGNARWMDFKP-UHFFFAOYSA-N 356.300 2.742 50 40 FFGB CCS(=O)(=O)[C@H](Br)[C@@H](O)c1ccc(Br)cc1 96519074 BFGMUYFZUFDMEZ-UWVGGRQHSA-N 372.078 2.638 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C/c1ccc(OC)cc1OC 3140307 FALSDOZSGDUOAN-UDWIEESQSA-N 358.394 2.632 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2CC=C[C@H]12)N/N=C1\C[C@@H]2CC=C[C@@H]12 13968997 KVMHVJCPUHROLG-ARWHPZKJSA-N 354.454 2.683 50 40 FFGB CCCCOC(=O)c1ccc(NC(=O)CCNC(=O)[C@H](C)Cl)cc1 8733247 FAJJZHGJXAUVTN-LBPRGKRZSA-N 354.834 2.716 50 40 FFGB COc1ccc2nc(NNC(=O)[C@H]3COc4ccccc4O3)sc2c1 4121404 WMUSQYLMHZGLIQ-CQSZACIVSA-N 357.391 2.588 50 40 FFGB COc1cc(/C=N/NC(=O)[C@@H](C)n2nnc3ccccc32)cc(Cl)c1O 1103476 FYNUOOJGCCFBDP-XTTRTJGBSA-N 373.800 2.510 50 40 FFGB C[C@H](Sc1ncccn1)C(=O)N/N=C/c1cccc(Br)c1 1436846 NTSAZFQVFUPEDH-NTOSSWPYSA-N 365.256 2.870 50 40 FFGB CC(C)CNC(=O)CSC1=C(C#N)[C@@H](c2ccc(F)cc2)CC(=O)N1 6306838 MJRKQWLMTCOSHI-CQSZACIVSA-N 361.442 2.670 50 40 FFGB COc1cccc(CC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1 6220282 PCPARUGNKZFOGH-UHFFFAOYSA-N 356.466 2.992 50 40 FFGB COc1ccc(/C=N/NC(=O)Nc2cccc3nsnc23)c(OC)c1 822452 XIFUUXSQUOEBOX-RQZCQDPDSA-N 357.395 2.864 50 40 FFGB COc1ccc(OCC(=O)N/N=C/c2ccco2)c(Br)c1 917849 KFEGCDIXFVOFOK-LZYBPNLTSA-N 353.172 2.580 50 40 FFGB CCCN1CCC(=NNC(=O)c2cc(Br)ccc2O)CC1 654877 IEVPAGIIVOFSAB-UHFFFAOYSA-N 354.248 2.746 50 40 FFGB C[C@H](SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1)C(=O)Nc1ccccc1 7252403 GXFTUMNLZBYUMN-WCQYABFASA-N 354.435 2.778 50 40 FFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2OC)cc1 7869235 FILNSXUHDYYVGJ-DEDYPNTBSA-N 355.394 2.573 50 40 FFGB CCN1C(=O)/C(=N\NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc21 101206135 SVDFREYWHBRJFD-CYVLTUHYSA-N 372.768 2.749 50 40 FFGB O=C(N/N=C/c1ccc(F)cc1)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 2290674 ZRPLVMFVMPGIQM-IMRMQAIZSA-N 359.788 2.982 50 40 FFGB CC[C@H](C)NC(=O)/C(C#N)=C/c1cc(Br)c(O)c(OC)c1 408796523 AKJNQANJZHKWIL-WUFUFFIZSA-N 353.216 2.985 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)C(=O)NCc1ccccc1 33768410 HRKCARHNFARYBK-NVNXTCNLSA-N 367.361 2.835 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccn2)cc1[N+](=O)[O-] 5130147 BSERZKNESHYTIN-HPAYWCODSA-N 360.395 2.629 50 40 FFGB CCSC1=C(C#N)[C@@H](c2ccccc2[N+](=O)[O-])[C@H](C(=O)OC)C(O)=N1 841865 OWZPJQRAKBMHDO-OLZOCXBDSA-N 361.379 2.926 50 40 FFGB CCc1cc2ccc(OC)cc2nc1SCC(=O)NNC(=O)C(C)C 4849393 AFTFMNSDTFTMBM-UHFFFAOYSA-N 361.467 2.701 50 40 FFGB O=S(=O)(NCC1CCCC1)c1ccc(OCCBr)cc1 95993339 MJKMIXHAZQEMDZ-UHFFFAOYSA-N 362.289 2.929 50 40 FFGB COC(=O)[C@](O)([C@H](Cl)C(=O)Nc1cccc(Cl)c1C)C(F)(F)F 2115270 KFKCVTWBLHBRMR-BXKDBHETSA-N 374.142 2.661 50 40 FFGB CC(C)(C)C(=O)Nc1ccc(C(=O)N/N=C/c2ccc(O)cc2O)cc1 59515242 BARBVWDRRLUFGT-RGVLZGJSSA-N 355.394 2.846 50 40 FFGB CCOc1ccccc1OCC(=O)N/N=C/c1cccc(OC)c1OC 5467380 IDQPWUZMVMRVKD-UDWIEESQSA-N 358.394 2.632 50 40 FFGB COC(=O)N/N=C/c1cc(Br)c(OC)c(Br)c1 4601908 WHTNLVMHLMBRTM-WLRTZDKTSA-N 366.009 2.910 50 40 FFGB CCOc1cc2c(cc1CNS(=O)(=O)CCCCCl)O[C@@H](C)C2 97163912 OWEAKMTTXOCKIJ-LBPRGKRZSA-N 361.891 2.847 50 40 FFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)cc1 408797610 GTLZTSQJCAPYEM-GXDHUFHOSA-N 354.337 2.923 50 40 FFGB O=C(NNS(=O)(=O)c1ccc2c3c(cccc13)CC2)c1ccccc1 226861155 PVTCNRLQWXEHKU-UHFFFAOYSA-N 352.415 2.562 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1cccc(OC2CSC2)c1 8169367 VDFGMOVFSWLIBS-KEBDBYFISA-N 372.446 2.719 50 40 FFGB O=C1c2ccccc2C(=O)N1SSN1C(=O)c2ccccc2C1=O 1038971 XVJMNRIABVPIOU-UHFFFAOYSA-N 356.384 2.790 50 40 FFGB in-vitro COc1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c(OC)c1 4491840 IIYPNJJHBFVBEG-UHFFFAOYSA-N 358.438 2.681 50 40 FFGB Cc1cccc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)c1 20207712 ZFVMSXDYUZIQCQ-UHFFFAOYSA-N 351.472 2.587 50 40 FFGB Cc1n[nH]c2c1[C@@H](c1ccc(OC(=O)c3ccco3)cc1)C(C#N)=C(N)O2 13119982 YNUGWMQBQHUMLQ-INIZCTEOSA-N 362.345 2.749 50 40 FFGB N#C/C(=C\c1ccccc1OCC(=O)O)C(=O)Nc1ccc(F)cc1F 13343835 LPXDYXITLXTBBK-KPKJPENVSA-N 358.300 2.974 50 40 FFGB COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)c2cc(C)n[nH]2)o1 8026383 RRPPNTDOGJHEKJ-GIJQJNRQSA-N 369.337 2.659 50 40 FFGB COc1cc(/C=N/NC(=O)Cc2ccc(C)cc2C)c([N+](=O)[O-])cc1OC 20194497 AYQUAXYIGHANAA-RGVLZGJSSA-N 371.393 2.922 50 40 FFGB O=C(CSc1nc2ccccc2o1)N/N=C/c1ccccc1C(=O)O 1478044 UMWJDVHPIOIAPB-GIJQJNRQSA-N 355.375 2.768 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)COc2ccccc2OC)cc1OC 6592032 RAIZSWHZNSJURZ-DEDYPNTBSA-N 358.394 2.632 50 40 FFGB O=C(Cc1ccccc1)Nc1ccc(C(=O)NNC(=O)c2ccco2)cc1 59421972 AKBDRJGEFZWRAQ-UHFFFAOYSA-N 363.373 2.536 50 40 FFGB Cc1ccc(/C=N/NC(=O)CCCCC(=O)N/N=C/c2ccc(C)o2)o1 5364044 BLMZAKYFIXMEGU-AYKLPDECSA-N 358.398 2.650 50 40 FFGB CCOC(=O)N/N=C(/c1c(C)nn(-c2ccccc2)c1O)C(F)(F)F 5790907 JAGWUUCSCLGRMK-UNOMPAQXSA-N 356.304 2.899 50 40 FFGB O=C(N/N=C/c1cccc2c1OCCO2)c1ccc(Br)cc1 408843850 UJDORYUCZKKNLU-VCHYOVAHSA-N 361.195 2.984 50 40 FFGB O=C(N/N=C/c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1ccccn1 5128164 ANGRPIARTRJXAI-SRZZPIQSSA-N 363.333 2.941 50 40 FFGB C[C@H](NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)cc1)c1ccccc1 6929830 FIRGBYDRLDOESU-MPMPPSQCSA-N 350.374 2.934 50 40 FFGB C=CCOc1cccc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)c1 408589882 NGVDNIVCIKZQBB-SRZZPIQSSA-N 353.378 2.542 50 40 FFGB O=C(N/N=C/c1cccnc1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 408972514 DCSWIKIVFZJFBU-ODCIPOBUSA-N 370.718 2.843 50 40 FFGB Cc1ccccc1C(=O)NNc1cc(N2CCCC2)nc(N2CCCC2)n1 5620224 ZXCBWHMYOBISAM-UHFFFAOYSA-N 366.469 2.742 50 40 FFGB C/C(=N\NC(=O)Cn1nc(C)c(Br)c1C)c1cccs1 5254443 TUMJBOZMTXZZOL-OVCLIPMQSA-N 355.261 2.864 50 40 FFGB COc1cccc(N2C[C@H](C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2=O)c1 7928723 NRTLNYACPKILLM-GFCCVEGCSA-N 356.334 2.562 50 40 FFGB CCCCn1nc(C(=O)N/N=C/c2ccc(O)cc2)c2ccccc2c1=O 6786701 FKKNIKAFFMYMRV-FYJGNVAPSA-N 364.405 2.666 50 40 FFGB C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)Cc1csc(N)n1 4455765 SNWBDFSNYSHGOC-LPYMAVHISA-N 373.482 2.714 50 40 FFGB O=S1(=O)CCc2ccccc2[C@H](Br)[C@@H]1Br 1653738 CBWQIAZOKMCABI-VHSXEESVSA-N 354.063 2.815 50 40 FFGB COC(=O)NNC(=O)COc1cc(C)c(Br)cc1C(C)C 2134959 IRWRRYOGHWHEEU-UHFFFAOYSA-N 359.220 2.647 50 40 FFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(N2CCCC2)cc1 4106707 QKSFWADJJJEGEJ-KGENOOAVSA-N 353.422 2.825 50 40 FFGB NC(=O)Cn1cc(/C=N/NC(=O)c2ccccc2Cl)c2ccccc21 33709421 MCSZAHHTJSIXEG-ZVBGSRNCSA-N 354.797 2.544 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc([N+](=O)[O-])c1O 16195073 AIAUHSYJCBQXCZ-WDZFZDKYSA-N 357.297 2.994 50 40 FFGB CC(=O)/C(C(=O)N(N)c1nc2ccccc2s1)=C(\C)N1CCCCC1 1413798 JWVVEBGZZJVCBI-VBKFSLOCSA-N 358.467 2.852 50 40 FFGB CCn1c(NNC(=O)C(C)(C)c2ccccc2)nc2ccccc2c1=O 32904541 HCWRYJDFXWPIQL-UHFFFAOYSA-N 350.422 2.837 50 40 FFGB Cc1ccccc1OCC(=O)NNC(=O)c1ccc(OC(F)(F)F)cc1 3393144 PFYRQDCCFLDDCD-UHFFFAOYSA-N 368.311 2.734 50 40 FFGB Cc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1C 6923822 UMXJLJRVGYYWOZ-UHFFFAOYSA-N 361.854 2.906 50 40 FFGB COc1ccc(NCC(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])cc1 3231670 KKJHDXGTJWZPGZ-FKTOWYLZSA-N 354.366 2.831 50 40 FFGB C=CCOc1c(Br)cc(/C=N/NC(=O)CCl)cc1OC 28217936 MQKTXSKWMIRGKP-LZYBPNLTSA-N 361.623 2.711 50 40 FFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc([N+](=O)[O-])cc2)cc1 408794066 HTADPHVWFBMAQE-GXDHUFHOSA-N 351.318 2.927 50 40 FFGB N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)NCc1ccco1 5451453 RYFLZDQNFNZXFV-PFONDFGASA-N 370.840 2.779 50 40 FFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1cc(Br)ccc1Cl 104547515 JCDMAKIYTNZIRN-YFHOEESVSA-N 357.591 2.585 50 40 FFGB COC(=O)CC1=C(C(=O)OC)[C@H](c2ccc(C(C)C)cc2)C(C#N)=C(N)O1 4476294 QGCFPEMAUCOYOH-QGZVFWFLSA-N 370.405 2.608 50 40 FFGB COc1ccccc1/C=N/NC(=O)C(NC(=O)c1ccccc1)=C(C)C 4855222 MURGKRWPJWOGBY-FYJGNVAPSA-N 351.406 2.869 50 40 FFGB CCOC(=O)NNC(=O)c1oc2ccccc2c1CSc1ncccn1 58421343 FRJWUCCVSWZDJH-UHFFFAOYSA-N 372.406 2.906 50 40 FFGB O=C(NNC(=O)c1sc2cc(F)ccc2c1Cl)c1cnns1 95363266 LVUWVCBHYKNXLE-UHFFFAOYSA-N 356.791 2.620 50 40 FFGB O=C(N/N=C/c1cccc(O)c1)c1ccc(I)cc1 10118496 PFVHBSMLHMEKEK-CXUHLZMHSA-N 366.158 2.761 50 40 FFGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 59515519 CMPFSGFPHKAZHW-KEBDBYFISA-N 353.378 2.628 50 40 FFGB COC(=O)/C(=N\NC(=O)c1ccccc1O)[C@H](C#N)c1ccc(Cl)cc1 5722468 RUMLQRVPIXXRHO-VDVBZYJVSA-N 371.780 2.612 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)c2ccc(Br)cc2)c2ccccc21 12411994 WSTMQDWJNIIYQY-XDJHFCHBSA-N 372.222 2.950 50 40 FFGB COc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)c([N+](=O)[O-])cc1OC 105410583 KNHUWRAENMYBRW-DALDERSTSA-N 361.398 2.888 50 40 FFGB CCOC(=O)C1=C(CBr)NC(=O)N[C@H]1c1ccc(Cl)cc1 3887502 GOASUOWJKOMELR-LBPRGKRZSA-N 373.634 2.906 50 40 FFGB Cc1cccc(C(=O)NCC(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1 4544255 SNCUVMHIGOIPOE-FSJBWODESA-N 367.449 2.910 50 40 FFGB Cc1cc(/C=N/NC(=O)C(=O)N2CCCCC2)c(C)n1-c1ccccc1F 408972305 QXTLKTAJHUPBNL-LPYMAVHISA-N 370.428 2.696 50 40 FFGB CCOc1ccc(C(=O)N/N=C/c2ccc(OC)c(OC)c2OC)cc1 5465373 BIGDBEZEYIDTEO-UDWIEESQSA-N 358.394 2.875 50 40 FFGB COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2F)cc([N+](=O)[O-])c1O 212600706 RIJMGFQOFDHYDU-WDZFZDKYSA-N 357.297 2.994 50 40 FFGB N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)[C@@H]1c1ccc(C(=O)O)cc1 101057445 FEJWHEGDYWFSNW-OAHLLOKOSA-N 372.336 2.526 50 40 FFGB Cc1cnc(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cn1 32525641 UPQDYQVNCUZEIT-UHFFFAOYSA-N 356.382 2.727 50 40 FFGB CC(C)CC(=O)NNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1 10161073 UEOHZPSQQZIICC-UHFFFAOYSA-N 366.421 2.720 50 40 FFGB N#CC1=C[C@@H]2CN(Cc3ccccc3)[C@H]1[C@H]1C(=O)N(c3ccccc3)C(=O)[C@H]21 61960955 MPBVULAEDBTSOF-AYWYSENESA-N 369.424 2.756 50 40 FFGB COc1cc(Br)cc(/C=N/NC(=O)c2cccs2)c1O 4132788 RWKCBMFAUIGBMC-VIZOYTHASA-N 355.213 2.989 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)COc2ccc(C)cc2C)c2ccccc21 5557465 XLZODSCWSKHRQX-ZBJSNUHESA-N 351.406 2.569 50 40 FFGB COc1ccc(/C=C/C(=O)NCC(=O)N/N=C(\C)Cc2ccccc2)cc1 4815281 ADXYQWAPHPOEQW-MZZZYUEISA-N 365.433 2.559 50 40 FFGB O=C(O)c1ccc(/C=N\NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1 32115746 KQZDRTMCFXFUEJ-SDPNRITHSA-N 360.185 2.668 50 40 FFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)C)c2C)cc1C 2054006 SENOKQZOPQWTSO-SRZZPIQSSA-N 354.454 2.686 50 40 FFGB CC1(CC(=O)N/N=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)OCCCO1 59426568 QFOUEPYZZBFHQQ-UDWIEESQSA-N 372.377 2.638 50 40 FFGB C[C@H](Oc1ccccc1[N+](=O)[O-])C(=O)N/N=C/c1c[nH]c2ccccc12 2766996 JMJDXTXPBRMSCG-DQAKUKQTSA-N 352.350 2.994 50 40 FFGB COc1ccc(NC(=O)N/N=C\c2ccc(O[C@H](C)C(=O)O)cc2)cc1 408851528 ZYNNCURPCBWYRV-ZDFPAGSVSA-N 357.366 2.703 50 40 FFGB CCNC(=O)N1[C@H](c2ccccc2)C(C#N)=C(O)N1c1nc(C)cc(C)n1 17074880 TTXDYGBVQGHYKG-MRXNPFEDSA-N 364.409 2.894 50 40 FFGB C[C@@H](NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)cc1)c1ccccc1 6932250 FIRGBYDRLDOESU-SWEABUAFSA-N 350.374 2.934 50 40 FFGB CC(C)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(O)c3)[C@H]2C1 4901802 PBMOQROQJMANGG-RBUKOAKNSA-N 359.433 2.526 50 40 FFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CSCc1ccccc1 8239164 ADANFDCHMOTHHT-ZDUSSCGKSA-N 362.426 2.674 50 40 FFGB COc1cc(C(=O)NN)ccc1OCc1ccc(Br)cc1 192504994 ZUIJGNWFAYWVBJ-UHFFFAOYSA-N 351.200 2.640 50 40 FFGB N#CC1=C(N)Oc2ccc3ccc(=O)oc3c2[C@H]1c1cccc([N+](=O)[O-])c1 5750104 JLYRDEYYMBXKBX-INIZCTEOSA-N 361.313 2.919 50 40 FFGB C[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1cccc(Br)c1 3148179 XDEIDXZSWLIWGC-ZGXHQARYSA-N 374.238 2.718 50 40 FFGB CCN1C(=O)/C(=N/NC(=O)c2cccc(Br)c2)c2ccccc21 6953738 DUBZLVXRJFWYQZ-XDJHFCHBSA-N 372.222 2.950 50 40 FFGB O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1)c1ccco1 8238302 MNVNMQZLATZOFF-UHFFFAOYSA-N 373.372 2.602 50 40 FFGB CC(=O)Oc1cccc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)c1 408757645 BGZBHQXBNCIDJB-VXLYETTFSA-N 368.418 2.731 50 40 FFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2cccc(Cl)c2)c1C 58913972 YYJKMFNJMFISCW-UUYOSTAYSA-N 372.856 2.890 50 40 FFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)[C@@H]1[C@H]2CCCC[C@@]21C 408722437 IVQJTYNCUVQSMB-UELKCOMZSA-N 361.398 2.888 50 40 FFGB CCCC[C@H](CC)CNC(=O)CCC(=O)NNC(=O)c1cccc(F)c1 4700576 ZJFAZOWUPHHLFL-AWEZNQCLSA-N 365.449 2.700 50 40 FFGB C[C@H]1C[C@H]1c1ccc(/C=C/C(=O)NNC(=O)COc2ccccc2C#N)o1 16205097 XLCNPCJJVPQKJY-IUCCYITESA-N 365.389 2.514 50 40 FFGB CCN(NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1ccc(C)cc1 8050896 QKJIPRZMDKTOKC-UHFFFAOYSA-N 357.366 2.861 50 40 FFGB COC(=O)/C(C#N)=C\c1ccc(-c2cc(C(=O)OC)cc(C(=O)OC)c2)o1 252501885 UKIRLWDOVJYICW-ZROIWOOFSA-N 369.329 2.600 50 40 FFGB O=C(N/N=C/c1ccccc1)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 5637243 WVJXYNMVMMMXBH-KGENOOAVSA-N 366.421 2.957 50 40 FFGB CC1=C(C(=O)OCCCCl)[C@H](c2ccc(N(C)C)cc2)NC(=O)N1 3899936 FNGKFCAHSARMIN-HNNXBMFYSA-N 351.834 2.553 50 40 FFGB CN(C)c1nc(N)nc(/C(C#N)=C/c2csc(-c3ccsc3)n2)n1 63278226 FJWWKYPZMIAENM-BJMVGYQFSA-N 355.452 2.769 50 40 FFGB COc1cc(/C=N/NC(=O)c2cccc(Cl)c2)ccc1OCC(=O)O 4502220 OVCQWBAKLRBXLA-DJKKODMXSA-N 362.769 2.576 50 40 FFGB O=C(/C=C/c1ccccc1)NNC(=O)CCC(=O)Nc1ccccc1Cl 5733893 BEHSMPRNYCSDEX-ZHACJKMWSA-N 371.824 2.920 50 40 FFGB Cn1c(=O)n(C)c2cc(/C=N/NC(=O)c3cccc4ccccc34)ccc21 408896194 QBIHTWSLJOLMAI-LPYMAVHISA-N 358.401 2.794 50 40 FFGB CCOc1ccc(/C=C(\C#N)C(=O)N2CCOCC2)cc1Br 408762016 JJVHVPKAWIAWTH-UKTHLTGXSA-N 365.227 2.614 50 40 FFGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCCO3)c(OC)c1 409360769 FTWICUJBWWWJGH-FYJGNVAPSA-N 370.405 2.558 50 40 FFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/C=C/c1cccc([N+](=O)[O-])c1 3148932 ULVLIAHMOPGERR-SRFURKKRSA-N 370.321 2.697 50 40 FFGB CC1(C)[C@]2(C(=O)O)CC[C@@]1(C)/C(=N/NC(=O)c1ccc(Cl)cc1)C2=O 13748760 PBDYJAHQGQMCFY-YZJQUUSSSA-N 362.813 2.906 50 40 FFGB C[C@H](CC(=O)NNC(=O)c1cncn1-c1ccc(F)cc1)c1ccccc1 6173658 DKLUFVKGOGWLJY-CQSZACIVSA-N 366.396 2.966 50 40 FFGB O=C(NC1CC1)[C@@H](NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccccc1 15473755 MEQDIBFMBAMXRG-NAVXVDNBSA-N 367.493 2.844 50 40 FFGB O=C(N/N=C/c1cc(Cl)cc(Br)c1O)c1ccccn1 1099776 TVWQVPVMGMTZRW-REZTVBANSA-N 354.591 2.967 50 40 FFGB CCSc1ncc(Cl)c(C(=O)NNC(=O)c2ccccc2Cl)n1 27666248 DAJRENIYNHHUSB-UHFFFAOYSA-N 371.249 2.970 50 40 FFGB CC(=O)O[C@]12[C@@H](Br)[C@@H]3[C@H]4C[C@@H]5[C@H]([C@H](Br)[C@@H]1[C@@H]53)[C@@H]42 100500310 OWYYCXRWCMJAHL-AZILCWPQSA-N 362.061 2.587 50 40 FFGB CCn1c(NNC(=O)c2ccc3ccccc3n2)nc2ccccc2c1=O 11156361 JGRVSPRRDMCMBW-UHFFFAOYSA-N 359.389 2.722 50 40 FFGB CCC(O)(CC)C(=O)NN(C(=O)c1cccnc1Cl)c1ccccc1 1780008 VYBGRPAQAVIVDL-UHFFFAOYSA-N 361.829 2.964 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1ccccc1C 4697795 ZGJZKTJXEVZDOX-HYARGMPZSA-N 367.405 2.901 50 40 FFGB O=C(COc1ccccc1Cc1ccccc1)NNC(=O)c1cccnc1 12802142 DUBDGZKCXPENHV-UHFFFAOYSA-N 361.401 2.512 50 40 FFGB O=C(CNc1ccc(F)cc1)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 409344895 JMEZLESZVDTQNK-UFWORHAWSA-N 350.737 2.950 50 40 FFGB CCOc1ccc(CN(C)C(=O)NNC(=O)c2ccc(C)cc2)cc1OC 8394928 OWCJDLWXITXEQK-UHFFFAOYSA-N 371.437 2.889 50 40 FFGB CCOC(=O)/C(C#N)=N/N(C(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 5795476 FEEABGDETNHQKA-CAPFRKAQSA-N 366.333 2.684 50 40 FFGB C=CCOc1ccc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cc1OC 6614650 VUZKBSRRDPPVTJ-FYJGNVAPSA-N 367.405 2.982 50 40 FFGB O=C(COC(=O)c1cccc(Cl)c1)NNC(=O)c1ccccc1Cl 7939897 CYHMOKMZXDRAFH-UHFFFAOYSA-N 367.188 2.611 50 40 FFGB C[C@H](SCc1ccccc1)C(=O)N/N=C1/C(=O)N(C)c2ccccc21 103727395 GGQYFDRNGLHAML-XXADUYMVSA-N 353.447 2.805 50 40 FFGB O=C(CCCCC(=O)N/N=C1\C[C@@H]2CC=C[C@H]12)N/N=C1\C[C@@H]2CC=C[C@H]12 13968990 KVMHVJCPUHROLG-QKMAYULPSA-N 354.454 2.683 50 40 FFGB C/C(CC(=O)Nc1ccc2c(c1)OCO2)=N\NC(=O)CCc1ccccc1 101512194 RZTOICMBEVCBNW-HYARGMPZSA-N 367.405 2.869 50 40 FFGB COc1cc(/C(C)=N/NC(=O)c2ccc(C)s2)ccc1OCC(=O)O 63425225 PRSHXCXLDSLOPK-WOJGMQOQSA-N 362.407 2.683 50 40 FFGB N#CC(C#N)=C1C(=O)Nc2c(Br)cc(Br)cc21 4590130 REJQQVNRZCZSDJ-UHFFFAOYSA-N 352.973 2.964 50 40 FFGB CC[C@H](NNC(=O)c1cn(C)c2ccccc12)C(=O)Nc1ccccc1 8747427 MGVWVPSFMKTPMS-KRWDZBQOSA-N 350.422 2.830 50 40 FFGB C[C@H](NC(=O)/C(C#N)=C/c1cccc(OCC(=O)O)c1)c1ccccc1 408813702 NUZMKRWOASVKHV-FBJMNJBLSA-N 350.374 2.934 50 40 FFGB CC1=C(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)C(C(=O)OCCC#N)=C(C)N1 59231204 PHQZIBXHYSVCRJ-QGZVFWFLSA-N 352.350 2.810 50 40 FFGB biogenic C[C@]12CC[C@H]([C@](Br)([N+](=O)[O-])C1=O)[C@@]2(C)CBr 16778597 QNOPRINAANCQME-MCNGFCJOSA-N 355.026 2.755 50 40 FFGB CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3F)[C@@H]2C1 1243268 DASOHEDSKCVXGD-AEFFLSMTSA-N 365.387 2.710 50 40 FFGB Cc1ccsc1/C=N/NC(=O)Cn1cnc2sc(C)c(C)c2c1=O 1784094 QKDJCJOHSSKIIC-NGYBGAFCSA-N 360.464 2.595 50 40 FFGB CC(=O)NN(c1ccccc1)[C@H]1C[C@H](C)N(c2ccccc2)N1C(C)=O 4131139 HTBSYNVMGJQISS-MGPUTAFESA-N 352.438 2.933 50 40 FFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CSc2nc(C)cc(C)n2)cc1 14186123 XYHIUUKUXITCIC-LPYMAVHISA-N 371.466 2.684 50 40 FFGB O=C(/C=C/c1cc(F)cc2c1OCOC2)NNc1ccccc1[N+](=O)[O-] 14198903 ZGBNOFVSZRYRTR-AATRIKPKSA-N 359.313 2.757 50 40 FFGB CCC(/C=N/CCBr)(CCC(=O)OC)CCC(=O)OC 17002846 AETWPLXSXNYTRC-LFIBNONCSA-N 350.253 2.755 50 40 FFGB C[C@]12CC[C@H]3[C@@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1C[C@@H](O)[C@]2(O)C#N 70669928 VZFYGLAXUCFBQI-XGDFDNKFSA-N 373.493 2.918 50 40 FFGB COc1ccc(/C=N/NC(=O)[C@@]2(C)NC(C)(C)Cc3ccccc32)cc1 19534957 NKJHWXBXVJQONI-PIUNUONSSA-N 351.450 2.985 50 40 FFGB COc1cccc(C(=O)N/N=C/c2ccc(I)o2)c1 10039457 FEVVWTYHUCRLGJ-OVCLIPMQSA-N 370.146 2.657 50 40 FFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1cc(-c2ccco2)n[nH]1 4194307 BGDWRJJXPQANQA-UHFFFAOYSA-N 354.410 2.647 50 40 FFGB N#CCOc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 408837253 AXRYARFMHULQQE-VXLYETTFSA-N 358.741 2.914 50 40 FFGB O=C(N/N=C/c1cc(O)ccc1[N+](=O)[O-])c1ccccc1Br 36236333 MTGSLKUHOLGNCP-LZYBPNLTSA-N 364.155 2.827 50 40 FFGB CCOc1cc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)ccc1OC 83292705 UINIBYHQKLWLDY-NDENLUEZSA-N 358.394 2.875 50 40 FFGB COC(=O)COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)cc1 1079026 AZOJQVPYIKXQIN-PVGUKEHMSA-N 372.446 2.869 50 40 FFGB COc1cc2c(cc1OC)[C@@H]1C/C(=N/NC(N)=O)[C@H](CC(C)C)CN1CC2 4433208 UZYMRVUJWGYPGN-YFFDSABZSA-N 374.485 2.693 50 40 FFGB Cc1ccc(OCCC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1C 40060236 BJSVWZUQTHIPHN-UHFFFAOYSA-N 355.438 2.600 50 40 FFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)NCc2ccccc2)cc1OC 4904473 YWZBHIRZRLTHHN-HYARGMPZSA-N 369.421 2.516 50 40 FFGB Cc1cc(C)cc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2)c1 1800468 MUBBHECAYXGYLY-UHFFFAOYSA-N 362.813 2.562 50 40 FFGB C=CCn1c(=O)c(C(=O)N/N=C/c2ccc(F)cc2)c(O)c2ccccc21 100498549 LDQZXBKCJCEGIZ-WSDLNYQXSA-N 365.364 2.796 50 40 FFGB CC1(C)Cc2c(cnn2-c2ccccc2)C(=O)/C1=N/NC(=O)c1ccncc1 103635784 KBKTZYFCQBKBSR-CLCOLTQESA-N 373.416 2.818 50 40 FFGB Cc1ccc(COc2ccc(/C=N/NC(=O)C(=O)NC(C)(C)C)cc2)cc1 3660011 DARNVZDCSGHEHQ-LPYMAVHISA-N 367.449 2.939 50 40 FFGB O=C(NNC(=O)c1ccco1)c1csc(COc2ccc(F)cc2)n1 13007910 HZKVGXIRVZYUIH-UHFFFAOYSA-N 361.354 2.529 50 40 FFGB COC(=O)c1ccccc1N/C=C(\C#N)C(=O)Nc1ccc(OC)cc1 95346253 CNJYFQUVBQPHMW-OUKQBFOZSA-N 351.362 2.940 50 40 FFGB O=C(Cc1cccs1)N/N=C1\C(=O)Nc2ccc(Br)cc21 13122602 XXYHRAUMFROFID-UHFFFAOYSA-N 364.224 2.526 50 40 FFGB CC/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc(OC)c(OC)c1 6377821 YJOVZDSYULSULW-KNGGAZFVSA-N 370.405 2.774 50 40 FFGB CN(C)c1cccc(C(=O)NNC(=O)c2ccc(Br)cc2)c1 12558206 MJRMTOQNGSOHDS-UHFFFAOYSA-N 362.227 2.590 50 40 FFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1ccc2c(c1)OCO2 4735250 SZCFLQWMXKMXRC-GIJQJNRQSA-N 361.195 2.871 50 40 FFGB COc1cc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cc(Cl)c1O 5176094 PVKRHYNVQWCCGY-DJKKODMXSA-N 361.785 2.777 50 40 FFGB Cc1ccc(OCC(=O)N/N=C2\N=C(N)c3ccccc32)c(C(C)(C)C)c1 16284686 WUMVUSWYVOTBAH-UHFFFAOYSA-N 364.449 2.868 50 40 FFGB COc1cccc(C(=O)N/N=C(\CC(=O)C(F)(F)F)c2ccccn2)c1 9042793 IJAWGCHGLRCDGN-HYARGMPZSA-N 365.311 2.746 50 40 FFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(C)cc1 408606250 PKUCOYXVZHLWDD-HNNXBMFYSA-N 354.435 2.943 50 40 FFGB COc1cc(/C=N/NC(=O)CCn2c(C)nc3ccccc32)ccc1O 13409805 MVRAHFMJHPXMTI-UDWIEESQSA-N 352.394 2.599 50 40 FFGB Cc1occc1C(=O)NNC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 50098483 CSXNUXZXIMVIPA-HNNXBMFYSA-N 363.801 2.669 50 40 FFGB CCOC(=O)C1=C(C)NC(C(C#N)C#N)=C(C#N)[C@@H]1c1ccc(F)cc1 100249135 UAJRVUKCLNLTBH-KRWDZBQOSA-N 350.353 2.791 50 40 FFGB N#C/C(=C/N1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(F)cc1 102820867 ZTBSUKMLMZOWBC-VLGSPTGOSA-N 364.424 2.989 50 40 FFGB O=C1NC[C@@H](c2ccccc2)[C@@H]1C(=O)N/N=C/c1ccc2ccccc2c1 676991 URMMYKMQBMBWSI-GZYHPDBMSA-N 357.413 2.820 50 40 FFGB